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2059934-81-3 | 5-nitrothieno[2,3-b]pyridine-2-carbaldehyde
CAS No: 2059934-81-3 Catalog No: AG01BZS8 MDL No:MFCD30486778
Product Description
Catalog Number:
AG01BZS8
Chemical Name:
5-nitrothieno[2,3-b]pyridine-2-carbaldehyde
CAS Number:
2059934-81-3
Molecular Formula:
C8H4N2O3S
Molecular Weight:
208.1940
MDL Number:
MFCD30486778
IUPAC Name:
5-nitrothieno[2,3-b]pyridine-2-carbaldehyde
InChI:
InChI=1S/C8H4N2O3S/c11-4-7-2-5-1-6(10(12)13)3-9-8(5)14-7/h1-4H
InChI Key:
TTWJUADAXYQWGK-UHFFFAOYSA-N
SMILES:
O=Cc1cc2c(s1)ncc(c2)[N+](=O)[O-]
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.994g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.191g/mol
Monoisotopic Mass:
207.994g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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