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Home > Pyridines > 114749-66-5
114749-66-5 | octahydro-1H-pyrido[1,2-a]pyrimidin-4-one
CAS No: 114749-66-5 Catalog No: AG01DUZW MDL No:MFCD20662932
Product Description
Catalog Number:
AG01DUZW
Chemical Name:
octahydro-1H-pyrido[1,2-a]pyrimidin-4-one
CAS Number:
114749-66-5
Molecular Formula:
C8H14N2O
Molecular Weight:
154.2096
MDL Number:
MFCD20662932
IUPAC Name:
1,2,3,6,7,8,9,9a-octahydropyrido[1,2-a]pyrimidin-4-one
InChI:
InChI=1S/C8H14N2O/c11-8-4-5-9-7-3-1-2-6-10(7)8/h7,9H,1-6H2
InChI Key:
XYMMYXUTZLEDDA-UHFFFAOYSA-N
SMILES:
O=C1CCNC2N1CCCC2
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.111g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.213g/mol
Monoisotopic Mass:
154.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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