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65871-80-9 | 2(1H)-Pyridinone,4-mercapto-(9CI)
CAS No: 65871-80-9 Catalog No: AG00FS7A MDL No:
Product Description
Catalog Number:
AG00FS7A
Chemical Name:
2(1H)-Pyridinone,4-mercapto-(9CI)
CAS Number:
65871-80-9
IUPAC Name:
4-sulfanyl-1H-pyridin-2-one
InChI:
InChI=1S/C5H5NOS/c7-5-3-4(8)1-2-6-5/h1-3H,(H2,6,7,8)
InChI Key:
WLHGWRDIQABYLV-UHFFFAOYSA-N
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.009g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
127.161g/mol
Monoisotopic Mass:
127.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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