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Home > Aldehydes > 188710-74-9
188710-74-9 | 1H-Imidazole-4-carboxaldehyde, 5-amino-1-methyl-2-phenyl-
CAS No: 188710-74-9 Catalog No: AG002H69 MDL No:
Product Description
Catalog Number:
AG002H69
Chemical Name:
1H-Imidazole-4-carboxaldehyde, 5-amino-1-methyl-2-phenyl-
CAS Number:
188710-74-9
Molecular Formula:
C11H11N3O
Molecular Weight:
201.2245
IUPAC Name:
5-amino-1-methyl-2-phenylimidazole-4-carbaldehyde
InChI:
InChI=1S/C11H11N3O/c1-14-10(12)9(7-15)13-11(14)8-5-3-2-4-6-8/h2-7H,12H2,1H3
InChI Key:
OBTPPIVYVAKEDH-UHFFFAOYSA-N
SMILES:
O=Cc1nc(n(c1N)C)c1ccccc1
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.229g/mol
Monoisotopic Mass:
201.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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