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Structure

Isothiocyanatophenyl sulfone

CAS
4430-49-3
Catalog Number
ACM4430493
Category
Other Products
Molecular Weight
332.42
Molecular Formula
C14H8N2O2S3

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Specification

Synonyms
NSC140913, CID284732, Isothiocyanic acid, sulfonyldi-p-phenylene ester, 1-Isothiocyanato-4-[(4-isothiocyanatophenyl)sulfonyl]benzene, 4430-49-3
IUPAC Name
1-isothiocyanato-4-(4-isothiocyanatophenyl)sulfonylbenzene
Canonical SMILES
C1=CC(=CC=C1N=C=S)S(=O)(=O)C2=CC=C(C=C2)N=C=S
InChI Key
PQCJXOVOHXALIO-UHFFFAOYSA-N
Boiling Point
547.4ºC at 760mmHg
Melting Point
187ºC
Flash Point
284.8ºC
Density
1.33g/cm³
Exact Mass
331.97500
H-Bond Acceptor
4
H-Bond Donor
0
Safety Description
S26-S36/37/39
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