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74944-29-9 | Imidazo[1,2-a]pyrimidine-3-carboxaldehyde,2-phenyl-
CAS No: 74944-29-9 Catalog No: AG0057ZG MDL No:MFCD06255242
Product Description
Catalog Number:
AG0057ZG
Chemical Name:
Imidazo[1,2-a]pyrimidine-3-carboxaldehyde,2-phenyl-
CAS Number:
74944-29-9
Molecular Formula:
C13H9N3O
Molecular Weight:
223.2301
MDL Number:
MFCD06255242
IUPAC Name:
2-phenylimidazo[1,2-a]pyrimidine-3-carbaldehyde
InChI:
InChI=1S/C13H9N3O/c17-9-11-12(10-5-2-1-3-6-10)15-13-14-7-4-8-16(11)13/h1-9H
InChI Key:
PEDHZELVODHMGJ-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc2n1cccn2)c1ccccc1
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.235g/mol
Monoisotopic Mass:
223.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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