Benzoic acid,2-isothiocyanato-, methyl ester

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Catalog Number
ACM16024821
Product Name
Benzoic acid,2-isothiocyanato-, methyl ester
Structure
Structure
CAS
16024-82-1
Category
Heterocyclic Organic Compound
Synonyms
Methyl 2-isothiocyanatobenzoate, ZINC00164763, CID85243, EINECS 240-164-2, SBB010050, 16024-82-1
IUPAC Name
methyl 2-isothiocyanatobenzoate
Molecular Weight
193.22
Molecular Formula
C9H7 N O2 S
Canonical SMILES
COC(=O)C1=CC=CC=C1N=C=S
InChI Key
UNXVHBOJSCWVCD-UHFFFAOYSA-N
Boiling Point
150ºC
Melting Point
25ºC
Flash Point
126ºC
Density
1.25
Appearance
DARK RED TO BROWN LIQUID
EC Number
240-164-2
Exact Mass
193.02000
Hazard Statements
Xn,Xi
H-Bond Acceptor
3
H-Bond Donor
0
Packing Group
III
Safety Description
S26-S37-S39
MSDS
Download MSDS
COA
Download COA
Spec Sheet
Download Spec Sheet
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