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Home > Imidazoles > 79877-53-5
79877-53-5 | 1H-BENZIMIDAZOLE, 6-METHOXY-2-PHENYL-
CAS No: 79877-53-5 Catalog No: AG00G9ZV MDL No:MFCD00626344
Product Description
Catalog Number:
AG00G9ZV
Chemical Name:
1H-BENZIMIDAZOLE, 6-METHOXY-2-PHENYL-
CAS Number:
79877-53-5
Molecular Formula:
C14H12N2O
Molecular Weight:
224.2579
MDL Number:
MFCD00626344
IUPAC Name:
6-methoxy-2-phenyl-1H-benzimidazole
InChI:
InChI=1S/C14H12N2O/c1-17-11-7-8-12-13(9-11)16-14(15-12)10-5-3-2-4-6-10/h2-9H,1H3,(H,15,16)
InChI Key:
SMHBLCFXCWISPZ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)[nH]c(n2)c1ccccc1
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.095g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.263g/mol
Monoisotopic Mass:
224.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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