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18354-57-9 | Ethanone, 1-thieno[2,3-b]pyridin-5-yl-
CAS No: 18354-57-9 Catalog No: AG0027NK MDL No:MFCD13193467
Product Description
Catalog Number:
AG0027NK
Chemical Name:
Ethanone, 1-thieno[2,3-b]pyridin-5-yl-
CAS Number:
18354-57-9
Molecular Formula:
C9H7NOS
Molecular Weight:
177.2230
MDL Number:
MFCD13193467
IUPAC Name:
1-thieno[2,3-b]pyridin-5-ylethanone
InChI:
InChI=1S/C9H7NOS/c1-6(11)8-4-7-2-3-12-9(7)10-5-8/h2-5H,1H3
InChI Key:
JWWSKIJONLURKI-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc2ccsc2nc1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.221g/mol
Monoisotopic Mass:
177.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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