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18853-40-2 | 2,5-Thiophenedicarbonitrile
CAS No: 18853-40-2 Catalog No: AG002GYF MDL No:
Product Description
Catalog Number:
AG002GYF
Chemical Name:
2,5-Thiophenedicarbonitrile
CAS Number:
18853-40-2
Molecular Formula:
C6H2N2S
Molecular Weight:
134.1585
IUPAC Name:
thiophene-2,5-dicarbonitrile
InChI:
InChI=1S/C6H2N2S/c7-3-5-1-2-6(4-8)9-5/h1-2H
InChI Key:
MYINLNBRJVGINA-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(s1)C#N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.994g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.156g/mol
Monoisotopic Mass:
133.994g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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