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39080-49-4 | 2,6-dimethyl-4H,6H,7H,8H,9H-pyrido[1,2-a]pyrimidin-4-one
CAS No: 39080-49-4 Catalog No: AG01BYRZ MDL No:MFCD30487360
Product Description
Catalog Number:
AG01BYRZ
Chemical Name:
2,6-dimethyl-4H,6H,7H,8H,9H-pyrido[1,2-a]pyrimidin-4-one
CAS Number:
39080-49-4
Molecular Formula:
C10H14N2O
Molecular Weight:
178.2310
MDL Number:
MFCD30487360
IUPAC Name:
2,6-dimethyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
InChI:
InChI=1S/C10H14N2O/c1-7-6-10(13)12-8(2)4-3-5-9(12)11-7/h6,8H,3-5H2,1-2H3
InChI Key:
URBGBHMINXIAOI-UHFFFAOYSA-N
SMILES:
Cc1cc(=O)n2c(n1)CCCC2C
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.111g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.235g/mol
Monoisotopic Mass:
178.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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