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Structure

Benzhydryl isothiocyanate

CAS
3550-21-8
Catalog Number
ACM3550218
Category
Other Products
Molecular Weight
225.31
Molecular Formula
C14H11NS

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Specification

Synonyms
Benzhydryl isothiocyanate, [Isothiocyanato(phenyl)methyl]benzene, 3550-21-8, isothiocyanatodiphenylmethane, ST50825755, diphenylmethanisothiocyanate, diphenylmethylisothiocyanate, ZINC02508121, AC1LAUNG, ACMC-20alq6, AC1Q7EXM, 591696_ALDRICH, CTK4H4673, MolPort-000-145-810, SBB096856, AKOS009158774, MCULE-7916895405, BP-11156, KB-75274, Benzene,1,1-(isothiocyanatomethylene)bis-
IUPAC Name
[isothiocyanato(phenyl)methyl]benzene
Canonical SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)N=C=S
InChI Key
WDOSFTZMBFYTED-UHFFFAOYSA-N
Boiling Point
160-165ºC 4mm
Melting Point
58ºC
Flash Point
163ºC
Density
1.05g/cm³
Exact Mass
225.06100
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
2
H-Bond Donor
0
Packing Group
III
Safety Description
S26-S36/37/39
WGK Germany
3
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