CAS
158628-56-9 Purity
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158628-56-9 Purity
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Benzene,1-isothiocyanato-4-(methylthio)-
CAS
15863-41-9
Catalog Number
ACM15863419
Category
Other Products
Molecular Weight
181.28
Molecular Formula
C8H7 N S2
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Specification
Synonyms
4-(Methylthio)phenyl isothiocyanate, 468509_ALDRICH, ZINC00152316, CID519185, 1-Isothiocyanato-4-(methylsulfanyl)benzene, BBV-104655, 15863-41-9
IUPAC Name
1-isothiocyanato-4-methylsulfanylbenzene
Canonical SMILES
CSC1=CC=C(C=C1)N=C=S
InChI Key
CEBAJHCAFXYWNT-UHFFFAOYSA-N
Boiling Point
127-128ºC1 mm Hg(lit.)
Melting Point
54-58ºC(lit.)
Flash Point
>230
Density
1.13 g/cm³
Appearance
yellow flakes and powder
Exact Mass
181.00200
Hazard Statements
C
H-Bond Acceptor
1
H-Bond Donor
0
Packing Group
II
Safety Description
S26
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CAS
15863-65-7 Purity
96%
15863-65-7 Purity
96%
