CAS
28081-52-9 Purity
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28081-52-9 Purity
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2-METHYLBENZOYL ISOTHIOCYANATE
CAS
28115-85-7
Catalog Number
ACM28115857
Category
Other Products
Molecular Weight
177.22
Molecular Formula
C9H7NOS
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Specification
Synonyms
2-Methylbenzoyl isothiocyanate, MolPort-000-157-068, ZINC02528091, CID141396, 28115-85-7
IUPAC Name
2-methylbenzoyl isothiocyanate
Canonical SMILES
CC1=CC=CC=C1C(=O)N=C=S
InChI Key
RBNGRYSMNUHYCW-UHFFFAOYSA-N
Boiling Point
282.1ºC at 760mmHg
Flash Point
124.4ºC
Density
1.11g/cm³
Exact Mass
177.02500
H-Bond Acceptor
1
H-Bond Donor
0
Safety Description
26-36/37/39
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