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207976-92-9 | 2(1H)-Pyridinone, 3-chloro-5,6-dihydro-
CAS No: 207976-92-9 Catalog No: AG002JE9 MDL No:MFCD18072446
Product Description
Catalog Number:
AG002JE9
Chemical Name:
2(1H)-Pyridinone, 3-chloro-5,6-dihydro-
CAS Number:
207976-92-9
Molecular Formula:
C5H6ClNO
Molecular Weight:
131.5602
MDL Number:
MFCD18072446
IUPAC Name:
5-chloro-2,3-dihydro-1H-pyridin-6-one
InChI:
InChI=1S/C5H6ClNO/c6-4-2-1-3-7-5(4)8/h2H,1,3H2,(H,7,8)
InChI Key:
MDCPVYOIYISUFL-UHFFFAOYSA-N
SMILES:
O=C1NCCC=C1Cl
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.014g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
131.559g/mol
Monoisotopic Mass:
131.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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