CAS
369656-75-7 Purity
96%
369656-75-7 Purity
96%
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Benzene,1-(isothiocyanatomethyl)-3-methyl-
CAS
3696-66-0
Catalog Number
ACM3696660
Category
Other Products
Molecular Weight
163.2395
Molecular Formula
C9H9NS
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Specification
Synonyms
3-Methylbenzyl isothiocyanate, MolPort-000-157-087, ZINC02528115, CID138010, 1-(Isothiocyanatomethyl)-3-methylbenzene, 3696-66-0
IUPAC Name
1-(isothiocyanatomethyl)-3-methylbenzene
Canonical SMILES
CC1=CC(=CC=C1)CN=C=S
InChI Key
NUXFAFWRXGFTQJ-UHFFFAOYSA-N
Boiling Point
262.8ºC at 760mmHg
Flash Point
113.7ºC
Density
1.01g/cm³
Exact Mass
163.04600
H-Bond Acceptor
1
H-Bond Donor
0
Safety Description
26-36/37/39
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