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102675-58-1 | 2(1H)-Pyridinone, 1-(3-aminopropyl)-
CAS No: 102675-58-1 Catalog No: AG00082U MDL No:MFCD09733687
Product Description
Catalog Number:
AG00082U
Chemical Name:
2(1H)-Pyridinone, 1-(3-aminopropyl)-
CAS Number:
102675-58-1
Molecular Formula:
C8H12N2O
Molecular Weight:
152.1937
MDL Number:
MFCD09733687
IUPAC Name:
1-(3-aminopropyl)pyridin-2-one
InChI:
InChI=1S/C8H12N2O/c9-5-3-7-10-6-2-1-4-8(10)11/h1-2,4,6H,3,5,7,9H2
InChI Key:
FMSYLYHUWPAOIM-UHFFFAOYSA-N
SMILES:
NCCCn1ccccc1=O
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.197g/mol
Monoisotopic Mass:
152.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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