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Home > Imidazoles > 58112-93-9
58112-93-9 | 2-(1-METHYL-1H-BENZIMIDAZOL-2-YL)-1-PHENYLETHANONE
CAS No: 58112-93-9 Catalog No: AG00F1DK MDL No:MFCD08691304
Product Description
Catalog Number:
AG00F1DK
Chemical Name:
2-(1-METHYL-1H-BENZIMIDAZOL-2-YL)-1-PHENYLETHANONE
CAS Number:
58112-93-9
Molecular Formula:
C16H14N2O
Molecular Weight:
250.2952
MDL Number:
MFCD08691304
IUPAC Name:
2-(1-methylbenzimidazol-2-yl)-1-phenylethanone
InChI:
InChI=1S/C16H14N2O/c1-18-14-10-6-5-9-13(14)17-16(18)11-15(19)12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChI Key:
DYLCLDYOAHTSPW-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Cc1nc2c(n1C)cccc2
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.301g/mol
Monoisotopic Mass:
250.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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