591378

Sigma-Aldrich

2-(4-Chlorophenethyl)isothiocyanate

97%

Synonym(s):
2-(4-Chlorophenyl)ethyl isothiocyanate
Empirical Formula (Hill Notation):
C9H8ClNS
CAS Number:
Molecular Weight:
197.68
MDL number:
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

97%

refractive index

n20/D 1.6000 (lit.)

density

1.215 g/mL at 25 °C (lit.)

storage temp.

2-8°C

SMILES string

Clc1ccc(CCN=C=S)cc1

InChI

1S/C9H8ClNS/c10-9-3-1-8(2-4-9)5-6-11-7-12/h1-4H,5-6H2

InChI key

MRJJYUJULSZFDV-UHFFFAOYSA-N

Pictograms

Exclamation markHealth hazard

Signal Word

Danger

hazcat

Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

storage_class_code

12 - Non Combustible Liquids

WGK Germany

WGK 3

Flash Point(F)

230.0 °F - closed cup

Flash Point(C)

> 110 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US),Eyeshields,Gloves

Certificate of Analysis

Certificate of Origin

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