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Home > Imidazoles > 167626-55-3
167626-55-3 | Benzoic acid, 4-(2-oxo-1-imidazolidinyl)-
CAS No: 167626-55-3 Catalog No: AG001XHA MDL No:MFCD11505356
Product Description
Catalog Number:
AG001XHA
Chemical Name:
Benzoic acid, 4-(2-oxo-1-imidazolidinyl)-
CAS Number:
167626-55-3
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD11505356
IUPAC Name:
4-(2-oxoimidazolidin-1-yl)benzoic acid
InChI:
InChI=1S/C10H10N2O3/c13-9(14)7-1-3-8(4-2-7)12-6-5-11-10(12)15/h1-4H,5-6H2,(H,11,15)(H,13,14)
InChI Key:
LCRVPYNHLNDERG-UHFFFAOYSA-N
SMILES:
O=C1NCCN1c1ccc(cc1)C(=O)O
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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