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Home > Nitro Compounds > 26579-59-9
26579-59-9 | Thieno[3,2-b]pyridine, 3-nitro-
CAS No: 26579-59-9 Catalog No: AG002TQS MDL No:MFCD21603851
Product Description
Catalog Number:
AG002TQS
Chemical Name:
Thieno[3,2-b]pyridine, 3-nitro-
CAS Number:
26579-59-9
Molecular Formula:
C7H4N2O2S
Molecular Weight:
180.1839
MDL Number:
MFCD21603851
IUPAC Name:
3-nitrothieno[3,2-b]pyridine
InChI:
InChI=1S/C7H4N2O2S/c10-9(11)5-4-12-6-2-1-3-8-7(5)6/h1-4H
InChI Key:
PZLPDVVGNDJTHK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1csc2c1nccc2
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.999g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.181g/mol
Monoisotopic Mass:
179.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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