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安全信息

456179

Sigma-Aldrich

苯乙基异氰酸酯

98%

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线性分子式:
C6H5CH2CH2NCO
CAS号:
1943-82-4
分子量:
147.17
EC 号:
413-080-0
MDL编号:
MFCD00037044
PubChem化学物质编号:
24869132
NACRES:
NA.22

检测方案

98%

折射率

n20/D 1.522 (lit.)

bp

210 °C (lit.)

密度

1.063 g/mL at 25 °C (lit.)

SMILES字符串

O=C=NCCc1ccccc1

InChI

1S/C9H9NO/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2

InChI key

HACRKYQRZABURO-UHFFFAOYSA-N

相关类别

警示用语：

Danger

危险分类

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Aquatic Chronic 2 - Resp. Sens. 1 - Skin Corr. 1A - Skin Sens. 1

储存分类代码

6.1C - Combustible, acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 2

闪点(°F)

212.0 °F - closed cup

闪点(°C)

100 °C - closed cup

个人防护装备

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

法规信息

危险化学品

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J Gal et al.
Drug metabolism and disposition: the biological fate of chemicals, 9(6), 557-560 (1981-11-01)
Chiral secondary alcohols were treated with (S)-(-)-1-phenylethyl isocyanate. For each racemic alcohol, the resulting diastereomeric urethane derivatives were resolved on flexible fused-silica capillary GLC columns with retention times of 15 min or less. Derivatization of individual enantiomers showed that the
Silica gel high-performance liquid chromatography for the simultaneous determination of propranolol and 4-hydroxypropranolol enantiomers after chiral derivatization.
M J Wilson et al.
Journal of chromatography, 310(2), 424-430 (1984-10-12)
Andreas Habel et al.
Journal of chromatography. A, 1165(1-2), 182-190 (2007-08-19)
1-phenylethyl isocyanate (1-PEIC), a chiral derivatisation reagent for the resolution of secondary alcohols is a powerful tool to determine the configuration and enantiomeric excess of medium- to long-chain secondary alcohols by capillary gas chromatography. The separation of 1-phenylethylcarbamates (1-PECs) of
A Adesida et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 34(4), 385-392 (1996-04-01)
Mercapturic acid pathway metabolites of phenylethyl isothiocyanate inhibited the growth of human leukaemia 60 (HL60) cells in vitro. The adduct with L-cysteine, S-(N-phenylethylthiocarbamoyl)cysteine, was the most potent with strong antileukaemic activity: the median growth inhibitory concentration (GC50) value was 336
E Albano et al.
Hepatology (Baltimore, Md.), 23(1), 155-163 (1996-01-01)
We have previously shown that the treatment with diallyl sulfide (DAS) and phenylethyl isothiocyanate (PIC) of rats receiving ethanol in the alcohol tube-feeding model effectively suppressed the induction of cytochrome P4502E1 (CYP2E1) by ethanol. Here we report that rat treatment
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