CAS
1135-01-9 Purity
96%
1135-01-9 Purity
96%
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1,3-Benzodioxole,5-isothiocyanato-
CAS
113504-93-1
Catalog Number
ACM113504931
Category
Other Products
Molecular Weight
179.1958
Molecular Formula
C8H5NO2S
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Specification
Synonyms
5-Isothiocyanato-1,3-benzodioxole, ZINC00158543, BB_SC-1834, 3,4-Methylenedioxyphenyl isothiocyanate, ALBB-003060, CID123593, STK501677, 113504-93-1
IUPAC Name
5-isothiocyanato-1,3-benzodioxole
SMILES
C1OC2=C(O1)C=C(C=C2)N=C=S
InChI Key
UVVSPZKAEJHDCY-UHFFFAOYSA-N
Boiling Point
311.2ºC at 760 mmHg
Melting Point
57ºC
Flash Point
142ºC
Density
1.37 g/cm³
Exact Mass
179.00400
Hazard Statements
T: Toxic;Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
26-36/37/39
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