3-[[4-[(6-Nitrobenzothiazol-2-yl)azo]phenyl]amino]propiononitrile

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Catalog Number
ACM61488764
Product Name
3-[[4-[(6-Nitrobenzothiazol-2-yl)azo]phenyl]amino]propiononitrile
Structure
Structure
CAS
61488-76-4
Category
Heterocyclic Organic Compound
Synonyms
EINECS 262-816-5, CID3017264, 3-((4-((6-Nitrobenzothiazol-2-yl)azo)phenyl)amino)propiononitrile, 61488-76-4
IUPAC Name
3-[4-[(6-nitro-1,3-benzothiazol-2-yl)diazenyl]anilino]propanenitrile
Molecular Weight
352.370480 [g/mol]
Molecular Formula
C16H12N6O2S
Canonical SMILES
C1=CC(=CC=C1NCCC#N)N=NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]
InChI Key
ZVXMPDZUGAZYOP-UHFFFAOYSA-N
Boiling Point
627.9ºC at 760 mmHg
Flash Point
333.5ºC
Density
1.46g/cm³
EC Number
262-816-5
Exact Mass
352.07400
H-Bond Acceptor
7
H-Bond Donor
1
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