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94882-00-5 | 2-Propoxy-4H-pyrido[1,2-a]pyrimidin-4-one
CAS No: 94882-00-5 Catalog No: AG01EZKW MDL No:
Product Description
Catalog Number:
AG01EZKW
Chemical Name:
2-Propoxy-4H-pyrido[1,2-a]pyrimidin-4-one
CAS Number:
94882-00-5
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
IUPAC Name:
2-propoxypyrido[1,2-a]pyrimidin-4-one
InChI:
InChI=1S/C11H12N2O2/c1-2-7-15-10-8-11(14)13-6-4-3-5-9(13)12-10/h3-6,8H,2,7H2,1H3
InChI Key:
ADWLEQHYPMISKG-UHFFFAOYSA-N
SMILES:
CCCOc1cc(=O)n2c(n1)cccc2
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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