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1439902-59-6 | 4-Amino-1-isopropylpyridin-2(1H)-one
CAS No: 1439902-59-6 Catalog No: AG01FDJP MDL No:
Product Description
Catalog Number:
AG01FDJP
Chemical Name:
4-Amino-1-isopropylpyridin-2(1H)-one
CAS Number:
1439902-59-6
Molecular Formula:
C8H12N2O
Molecular Weight:
152.1937
IUPAC Name:
4-amino-1-propan-2-ylpyridin-2-one
InChI:
InChI=1S/C8H12N2O/c1-6(2)10-4-3-7(9)5-8(10)11/h3-6H,9H2,1-2H3
InChI Key:
MYYVPDVHZISJTC-UHFFFAOYSA-N
SMILES:
Nc1ccn(c(=O)c1)C(C)C
Properties
Complexity:
228
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:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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