3-(Bromomethyl)phenyl isothiocyanate

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Catalog Number
ACM155863313
Product Name
3-(Bromomethyl)phenyl isothiocyanate
Structure
Structure
CAS
155863-31-3
Category
Heterocyclic Organic Compound
Synonyms
3-(Bromomethyl)phenyl isothiocyanate, 3-Isothiocyanatobenzyl bromide, 155863-31-3, 40902_ALDRICH, 40902_FLUKA, CTK4C8861, AG-E-04361, Benzene,1-(bromomethyl)-3-isothiocyanato-
IUPAC Name
1-(bromomethyl)-3-isothiocyanatobenzene
Molecular Weight
228.11
Molecular Formula
C8H6BrNS
Canonical SMILES
C1=CC(=CC(=C1)N=C=S)CBr
InChI Key
OTUFZEMMKGWNCT-UHFFFAOYSA-N
Boiling Point
320.794ºC at 760 mmHg
Melting Point
35-38ºC
Flash Point
147.811ºC
Density
1.438g/cm³
Exact Mass
226.94000
Hazard Statements
T: Toxic;
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
S22
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