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71681-34-0 | Propanedinitrile, 2-thiazolyl- (9CI)
CAS No: 71681-34-0 Catalog No: AG00FV55 MDL No:
Product Description
Catalog Number:
AG00FV55
Chemical Name:
Propanedinitrile, 2-thiazolyl- (9CI)
CAS Number:
71681-34-0
IUPAC Name:
2-(1,3-thiazol-2-yl)propanedinitrile
InChI:
InChI=1S/C6H3N3S/c7-3-5(4-8)6-9-1-2-10-6/h1-2,5H
InChI Key:
NCXHGHDGPYKVJO-UHFFFAOYSA-N
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.005g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.171g/mol
Monoisotopic Mass:
149.005g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
88.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| Aromatic/proaromatic donors in 2-dicyanomethylenethiazole merocyanines: from neutral to strongly zwitterionic nonlinear optical chromophores. | Chemistry (Weinheim an der Bergstrasse, Germany) 20110117 |
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