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Home > Imidazoles > 172753-91-2
172753-91-2 | 1-methyl-1H-benzo[d]imidazol-2-yl(phenyl)phosphinic acid
CAS No: 172753-91-2 Catalog No: AG01CU5O MDL No:MFCD01238471
Product Description
Catalog Number:
AG01CU5O
Chemical Name:
1-methyl-1H-benzo[d]imidazol-2-yl(phenyl)phosphinic acid
CAS Number:
172753-91-2
Molecular Formula:
C14H13N2O2P
Molecular Weight:
272.2390
MDL Number:
MFCD01238471
IUPAC Name:
(1-methylbenzimidazol-2-yl)-phenylphosphinic acid
InChI:
InChI=1S/C14H13N2O2P/c1-16-13-10-6-5-9-12(13)15-14(16)19(17,18)11-7-3-2-4-8-11/h2-10H,1H3,(H,17,18)
InChI Key:
BWJZHTJXOGNWEY-UHFFFAOYSA-N
SMILES:
Cn1c2ccccc2nc1P(=O)(c1ccccc1)O
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.071g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.244g/mol
Monoisotopic Mass:
272.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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