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89021-16-9 | Imidazo[1,2-a]pyrimidine-3-carboxaldehyde, 2-(1-methylethyl)-
CAS No: 89021-16-9 Catalog No: AG0042SB MDL No:
Product Description
Catalog Number:
AG0042SB
Chemical Name:
Imidazo[1,2-a]pyrimidine-3-carboxaldehyde, 2-(1-methylethyl)-
CAS Number:
89021-16-9
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
IUPAC Name:
2-propan-2-ylimidazo[1,2-a]pyrimidine-3-carbaldehyde
InChI:
InChI=1S/C10H11N3O/c1-7(2)9-8(6-14)13-5-3-4-11-10(13)12-9/h3-7H,1-2H3
InChI Key:
MLHVFDRAXYYROU-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc2n1cccn2)C(C)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.218g/mol
Monoisotopic Mass:
189.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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