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CAS: 97-54-1
分子式: C10H12O2
分子量: 164.20
沸点: 266-268℃
熔点: -10℃
中文名称: 
异丁子香酚
2-甲氧基-(1-丙烯)酚
异丁香油酚
异丁香酚
对丙烯基邻甲氧基本酚
2-甲氧基-4-(1-丙烯基)-苯酚
英文名称: 
iso-Eugenol
2-Methoxy-4-(1-propenyl)phenol
5-Propenylguaiacol
2-methoxy-4-(1-propenyl)-Phenol
2-methoxy-4-propenyl-pheno
1-hydroxy-2-methoxy-4-propenylbenzene
4-hydroxy-3-methoxy-1-propenylbenzene
isoeugenol
nci-c60979
2-methoxy-4-(1-propenyl)-pheno
isoeugenol, mixture of cis/trans isomers
2-methoxy-4-propenyl-phenol
4-Propenyl-2-methoxyphenol
Phenol,2-methoxy-4-(1-propenyl)-
展开更多英文名
性质描述: 该品是顺、反两种异构体的混合物,枯中反式占82-88%。反式[5932-68-3]熔点33℃,沸点266℃,140-141℃(1.6千帕)。市售品熔点约13℃,沸点266℃,相对密度1.080(25/4℃),折光率1.5748,闪点134℃,能与醇、醚混溶,难溶于水。纯品为无色或淡黄色油状液体,易变成黄色。
生产方法: 由丁子香酚在氢氧化钾溶液中加热异构化而得。用氢氧化钾溶液处理丁子香酚或富含丁子香酚的精油,使其转化成盐。然后加热异构化。冷却后,用稀硫酸分解碱金属盐,游离出异丁子香酚,水洗,干燥,减压蒸馏即得成品。异丁子香酚天然存在于依兰依兰油、肉豆蔻油中。除用丁子香酚异构化的方法制备以外,在工业上还采用黄樟油素或异黄樟油素的合成法制取。
用途: 异丁子香酚香调较丁子香酚优雅。常用作康乃馨精的主剂,其他各种花香香精也广为应用。用作化妆品和皂用香精等。该品还可作为食品的香产,用于苹果、杏、香蕉、葡萄、李子、覆盆子(树莓)或胡桃类的食品等香精。此外,在牙科药物中也有应用。
推荐供应商
货号品牌产品名称规格包装、参考价格详情
I794535MACKLIN异丁香酚(正+反)10mM in DMSO648元/1ml;   展开
储存:-20°C
I811861MACKLIN异丁香酚97%,顺反异构体混和物55元/25g;   126元/100g;   421元/500g;   1648元/2.5kg;   展开
储存:室温
状态:无色到浅黄色液体
折射率:n20/D 1.575(lit.)
I0132TCIIsoeugenol (cis- and trans- mixture)>97.0%(GC)150元/25G;   290元/100G;   990元/500G;   展开

基本信息

纯度/分析方法>97.0%(GC)
分子式/分子量C10H12O2 = 164.20
外观与形状(20℃)液体
Reaxys-RN2046156
PubChem物质ID87571520
Merck Index (14)5171
MDL编号MFCD00009285

技术规格

AppearanceColorless to Yellow to Green clear liquid
Purity(GC)min. 98.0 %(total of isomer)

物性(参考值)

闪点134 ℃
比重1.08
折射率1.58

安全信息

图形或危害标志
信号词警告
危险性说明H302 + H312 : 吞咽或皮肤接触有害。
H315 : 造成皮肤刺激。
H319 : 造成严重眼刺激。
H371 : 可能损害器官。
H373 : 长期或反复接触可能损害器官。
H317 : 可能造成皮肤过敏反应。
防范说明P501 : 将内装物/容器送到批准的废物处理厂处理。
P272 : 受沾染的工作服不得带出工作场地。
P260 : 不要吸入粉尘/ 烟/ 气体/ 烟雾/ 蒸气/ 喷雾。
P270 : 使用本产品时不要进食、饮水或吸烟。
P264 : 作业后彻底清洗皮肤。
P280 : 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。
P337 + P313 : 如仍觉眼刺激:求医/就诊。
P305 + P351 + P338 : 如进入眼睛:用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出,取出隐形眼镜。继续冲洗。
P308+P311 : 如接触到或有疑虑:呼叫急救中心/医生。
P362+P364 : 脱掉沾污的衣服,清洗后方可重新使用。
P333 + P313 : 如发生皮肤刺激或皮疹:求医/就诊。
P301 + P312 + P330 : 如误吞咽:如感觉不适,呼叫急救中心/医生。漱口。
P302 + P352 + P312 : 如皮肤沾染:用水充分清洗。如感觉不适,呼叫急救中心/医生。
P405 : 存放处须加锁。

相关法规

RTECS#SL7875000
142797J&KIsoeugenol97%, 顺反异构体混合物165元/25G;   348元/100G;   1462元/500G;   展开

基本信息

分子式C10H12O2
分子量164.20
熔点27
沸点132
闪点112
密度1.077
折光率(n20D)1.5650 – 1.5850
MDL编码MFCD00009285
Beilstein1909602
EINECS 编号202-590-7

安全信息

图形或危害标志
提示语Warning
危险说明H302
H315
H317
H319
H335
防范说明P261
P280
P305+P351+P338
WGK3
RTECSSL7875000
B24541Alfa AesarIsoeugenolcis + trans, 98%707元/25g;   887元/100g;   3722元/500g;   展开

基本信息

MDL
MFCD00009285

EINECS
202-590-7

分子式
C10H12O2

分子量
164.21

熔点
-10°

沸点
266-268°

闪点
134°(273°F)

密度
1.080

折射率
1.5770

形态
Liquid

Beilstein
1909602

Merck
14,5171

GHS危害和防范说明

GHS符号

Hazard Statements
H302-H315-H319-H335
Harmful if swallowed.Causes skin irritation.Causes serious eye irritation.May cause respiratory irritation.

Precautionary Statements
P261-P280a-P305+P351+P338-P304+P340-P405-P501a
Avoid breathing dust/fume/gas/mist/vapours/spray.Wear protective gloves and eye/face protection.IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing.Store locked up.Dispose of contents/container in accordance with local/regional/national/international regulations.

安全信息

危险类别
22-36/37/38
Harmful if swallowed.Irritating to eyes, respiratory system and skin.

安全等级
26-36/37
In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.Wear suitable protective clothing and gloves.

欧盟危险品标志

RTECS
SL7875000

TSCA

C12257Alfa AesarIsoeugenol99%, mixture of cis/trans isomers557元/5g;   851元/100g;   3217元/500g;   展开

基本信息

Ref#
12257

MDL
9285

分子式
C10 H12 O2

分子量
164.2

闪点
150

密度
1.09

形态
Yellow liquid

I17206Sigma-AldrichIsoeugenol98%, mixture of cis and trans408.24元/5 G;   481.43元/100 G;   展开

产品说明

包装

5, 100 g in glass bottle

其他说明

斯克里普斯代谢组学和质谱技术中心独立生成的串联质谱数据可在PDF ( I17206.pdf )中查看或下载。斯克里普斯代谢物组学和质谱技术中心的METLIN代谢物数据库中有测试代谢物。要了解更多信息,请访问sigma.com/metlin。

基本信息

线性分子式CH3OC6H3(CH=CHCH3)OH
分子量164.20
Beilstein1909602
EC 号202-590-7
MDL编号MFCD00009285
PubChem化学物质编号24895941

产品性质

质量水平100
蒸汽密度>1 (vs air)
蒸汽压<0.01 mmHg ( 20 ℃)
测定98%
折射率n20/D 1.575 (lit.)
bp132 ℃/10 mmHg (lit.)
mp27 ℃ (lit.)
密度1.077 g/mL at 25 ℃
SMILES stringOC1=CC=C(/C=C/C)C=C1OC
InChI1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+
InChI keyBJIOGJUNALELMI-ONEGZZNKSA-N
Gene Informationrat ... Ar(24208)

安全信息

象形图GHS07
警示用语:Warning
危险声明H317
预防措施声明P261 - P272 - P280 - P302 + P352 - P333 + P313 - P362 + P364
危险分类Skin Sens. 1A
储存分类代码11 - Combustible Solids
WGKWGK 2
闪点(F)233.6 °F - closed cup
闪点(C)112 ℃ - closed cup
个人防护装备dust mask type N95 (US), Eyeshields, Faceshields, Gloves
W246808Sigma-AldrichIsoeugenolmixture of cis and trans, 99%, FG442.95元/;   2323.72元/1 KG;   13582.4元/10 KG;   展开

基本信息

线性分子式CH3OC6H3(CH=CHCH3)OH
分子量164.20
FEMA编号2468
Beilstein1909602
EC 号202-590-7
欧洲委员会编号172
MDL编号MFCD00009285
PubChem化学物质编号24901116
Flavis编号4.004
NACRESNA.21

产品性质

质量水平400
生物来源synthetic
等级FG
Halal
Kosher
agencyfollows IFRA guidelines
meets purity specifications of JECFA
reg. complianceEU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 117
FDA 21 CFR 172.515
蒸汽密度>1 (vs air)
蒸汽压<0.01 mmHg ( 20 ℃)
测定99%
组成contains IFRA restricted Isoeugenol
折射率n20/D 1.575 (lit.)
bp132 ℃/10 mmHg (lit.)
密度1.082 g/mL at 25 ℃
application(s)flavors and fragrances
文件see Safety & Documentation for available documents
食品过敏原no known allergens
致敏芳香化合物isoeugenol
性状检查clove; woody; spicy; sweet
SMILES stringOC1=CC=C(/C=C/C)C=C1OC
InChI1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+
InChI keyBJIOGJUNALELMI-ONEGZZNKSA-N
Gene Informationrat ... Ar(24208)

安全信息

象形图GHS07
警示用语:Warning
危险声明H317
预防措施声明P261 - P272 - P280 - P302 + P352 - P333 + P313 - P362 + P364
危险分类Skin Sens. 1A
储存分类代码11 - Combustible Solids
WGKWGK 2
闪点(F)233.6 °F - closed cup
闪点(C)112 ℃ - closed cup
个人防护装备dust mask type N95 (US), Eyeshields, Faceshields, Gloves
W246830Sigma-AldrichIsoeugenolnatural, 99%, FG643.42元/;   1426.25元/1 KG;   展开

基本信息

线性分子式CH3OC6H3(CH=CHCH3)OH
分子量164.20
FEMA编号2468
Beilstein1909602
EC 号202-590-7
MDL编号MFCD00009285
PubChem化学物质编号329830495
Flavis编号4.004
NACRESNA.21

产品性质

生物来源Betel leaf oil
质量水平400
等级FG
Halal
Kosher
natural
agencyfollows IFRA guidelines
reg. complianceEU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 117
蒸汽密度>1 (vs air)
蒸汽压<0.01 mmHg ( 20 ℃)
测定99%
组成contains IFRA restricted Isoeugenol
折射率n20/D 1.575 (lit.)
bp132 ℃/10 mmHg (lit.)
密度1.083 g/mL at 25 ℃
文件see Safety & Documentation for available documents
性状检查clove; spicy; woody; smoky; sweet
application(s)flavors and fragrances
食品过敏原no known allergens
致敏芳香化合物isoeugenol
SMILES stringOC1=CC=C(/C=C/C)C=C1OC
InChI1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+
InChI keyBJIOGJUNALELMI-ONEGZZNKSA-N

安全信息

象形图GHS07
警示用语:Warning
危险声明H317
预防措施声明P261 - P272 - P280 - P302 + P352 - P333 + P313 - P362 + P364
危险分类Skin Sens. 1A
储存分类代码10 - Combustible liquids
WGKWGK 2
闪点(F)233.6 °F - closed cup
闪点(C)112 ℃ - closed cup
34038SupelcoIsoeugenolanalytical standard1332.39元/5 ML;   展开

产品说明

一般描述

Isoeugenol belongs to the class of phenylpropenes, naturally occurring in the essential oils of plants. It can also be obtained from eugenol by isomerization. It has been used as a substrate in the preparation of vanillin via enzymatic transformation by lipoxygenase enzyme.

应用

Isoeugenol may be used as an analytical reference standard for the determination of the analyte in bioconversion broth using reversed-phase high-performance liquid chromatography with ultraviolet detection (RP-HPLC-UV).
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

基本信息

线性分子式CH3OC6H3(CH=CHCH3)OH
分子量164.20
Beilstein1909602
EC 号202-590-7
MDL编号MFCD00009285
PubChem化学物质编号329754773
NACRESNA.24

产品性质

质量水平100
等级analytical standard
蒸汽密度>1 (vs air)
蒸汽压<0.01 mmHg ( 20 ℃)
保质期limited shelf life, expiry date on the label
technique(s)HPLC: suitable
gas chromatography (GC): suitable
折射率n20/D 1.575 (lit.)
bp132 ℃/10 mmHg (lit.)
密度1.084 g/cm3
application(s)cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care
格式neat
SMILES stringOC1=CC=C(/C=C/C)C=C1OC
InChI1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+
InChI keyBJIOGJUNALELMI-ONEGZZNKSA-N

安全信息

象形图GHS07
警示用语:Warning
危险声明H317
预防措施声明P261 - P272 - P280 - P302 + P352 - P333 + P313 - P362 + P364
危险分类Skin Sens. 1A
储存分类代码11 - Combustible Solids
WGKWGK 2
闪点(F)233.6 °F - closed cup
闪点(C)112 ℃ - closed cup
个人防护装备dust mask type N95 (US), Eyeshields, Faceshields, Gloves
1348532USPIsoeugenolUnited States Pharmacopeia (USP) Reference Standard4353.35元/0.2 ML;   展开

产品说明

一般描述

This Certified Reference Material (CRM) is produced and certified in accordance with ISO 17034 and ISO/IEC 17025. All information regarding the use of this CRM can be found on the certificate of analysis.

分析说明

These products are for test and assay use only. They are not meant for administration to humans or animals and cannot be used to diagnose, treat, or cure diseases of any kind.

其他说明

USP issued SDS can be found here.
Sales restrictions may apply.

基本信息

线性分子式CH3OC6H3(CH=CHCH3)OH
分子量164.20
Beilstein1909602
MDL编号MFCD00009285

产品性质

蒸汽密度>1 (vs air)
蒸汽压<0.01 mmHg ( 20 ℃)
包装pkg of 0.2 mL
折射率n20/D 1.575 (lit.)
bp132 ℃/10 mmHg (lit.)
application(s)pharmaceutical (small molecule)
格式neat
储存温度−20℃
SMILES stringOC1=CC=C(/C=C/C)C=C1OC
InChI1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+
InChI keyBJIOGJUNALELMI-ONEGZZNKSA-N

安全信息

象形图GHS07
警示用语:Warning
危险声明H317
预防措施声明P261 - P272 - P280 - P302 + P352 - P333 + P313 - P362 + P364
危险分类Skin Sens. 1A
储存分类代码10 - Combustible liquids
WGKWGK 2
闪点(F)233.6 °F - closed cup
闪点(C)112 ℃ - closed cup
ALR-007NAccuStandardIsoeugenol309元/100mg;   展开
Isoeugenol异丁香酚97-54-1
ALR-007S-ET-10XAccuStandardIsoeugenol,1000 μg/mL in Ethanol1000 μg/mL in Ethanol309元/1mL;   展开
Isoeugenol异丁香酚97-54-11000 µg/mL
242656Fluorochem2-Methoxy-4-(prop-1-en-1-yl)phenol95%220元/10g;   352元/25g;   814元/100g;   2684元/500g;   展开

基本信息

CAS Number97-54-1
MDL NumberMFCD00009285
Density1.08

安全信息

图形或危害标志
危险性说明 H302: Harmful if swallowed.
H315: Causes skin irritation.
H317: May cause an allergic skin reaction.
H319: Causes serious eye irritation.
H335: May cause respiratory irritation.
防范说明 P233: Keep container tightly closed.
P260: Do not breathe .
P261: Avoid breathing
P264: Wash hands thoroughly after handling.
P270: Do not eat, drink or smoke when using this product.
P271: Use only outdoors or in a well-ventilated area.
P272: Contaminated work clothing should not be allowed out of the workplace.
P280: Wear .
P301 + P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.
P302 + P352: IF ON SKIN: Wash with plenty of soap and water.
P304: IF INHALED: .
P304 + P340: IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P312: Call a POISON CENTER or doctor/physician if you feel unwell.
P321: Specific treatment (see . on this label).
P330: Rinse mouth.
P332 + P313: If skin irritation occurs: Get medical advice/ attention.
P333 + P313: If skin irritation or rash occurs: Get medical advice/attention.
P337 + P313: If eye irritation persists: Get medical advice/attention.
P340: Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P362: Take off contaminated clothing and wash before reuse.
P363: Wash contaminated clothing before reuse.
P403: Store in a well-ventilated place.
P403 + P233: Store in a well-ventilated place. Keep container tightly closed.
P405: Store locked up.
P501: Dispose of contents/container to local regulations.
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