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Home > Imidazoles > 76081-98-6
76081-98-6 | 2-METHYL-8-(PHENYLMETHOXY)IMIDAZO[1,2-A]PYRIDINE-3-ACETONITRILE
CAS No: 76081-98-6 Catalog No: AG00G2EO MDL No:MFCD00834620
Product Description
Catalog Number:
AG00G2EO
Chemical Name:
2-METHYL-8-(PHENYLMETHOXY)IMIDAZO[1,2-A]PYRIDINE-3-ACETONITRILE
CAS Number:
76081-98-6
Molecular Formula:
C17H15N3O
Molecular Weight:
277.3205
MDL Number:
MFCD00834620
IUPAC Name:
2-(2-methyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetonitrile
InChI:
InChI=1S/C17H15N3O/c1-13-15(9-10-18)20-11-5-8-16(17(20)19-13)21-12-14-6-3-2-4-7-14/h2-8,11H,9,12H2,1H3
InChI Key:
PYKJFEPAUKAXNN-UHFFFAOYSA-N
SMILES:
N#CCc1c(C)nc2n1cccc2OCc1ccccc1
UNII:
00427X161I
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.122g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.327g/mol
Monoisotopic Mass:
277.122g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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