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88875-17-6 | Imidazo[1,5-a]pyrimidine, 2-methoxy-4,6-dimethyl-
CAS No: 88875-17-6 Catalog No: AG0049K3 MDL No:MFCD21336598
Product Description
Catalog Number:
AG0049K3
Chemical Name:
Imidazo[1,5-a]pyrimidine, 2-methoxy-4,6-dimethyl-
CAS Number:
88875-17-6
Molecular Formula:
C9H11N3O
Molecular Weight:
177.2031
MDL Number:
MFCD21336598
IUPAC Name:
2-methoxy-4,6-dimethylimidazo[1,5-a]pyrimidine
InChI:
InChI=1S/C9H11N3O/c1-6-4-9(13-3)11-8-5-10-7(2)12(6)8/h4-5H,1-3H3
InChI Key:
IBNOFBJFEUNSRP-UHFFFAOYSA-N
SMILES:
COc1cc(C)n2c(n1)cnc2C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.09g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.207g/mol
Monoisotopic Mass:
177.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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