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37986-04-2 | 5-methyl-4H,7H-thieno[3,2-b]pyridin-7-one
CAS No: 37986-04-2 Catalog No: AG01E95J MDL No:MFCD21759581
Product Description
Catalog Number:
AG01E95J
Chemical Name:
5-methyl-4H,7H-thieno[3,2-b]pyridin-7-one
CAS Number:
37986-04-2
Molecular Formula:
C8H7NOS
Molecular Weight:
165.2123
MDL Number:
MFCD21759581
IUPAC Name:
5-methyl-4H-thieno[3,2-b]pyridin-7-one
InChI:
InChI=1S/C8H7NOS/c1-5-4-7(10)8-6(9-5)2-3-11-8/h2-4H,1H3,(H,9,10)
InChI Key:
JAFYEZHFGJPUDV-UHFFFAOYSA-N
SMILES:
Cc1cc(=O)c2c([nH]1)ccs2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.21g/mol
Monoisotopic Mass:
165.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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