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Home > Imidazoles > 69053-50-5
69053-50-5 | 2H-Benzimidazol-2-one,1,3-dihydro-4-hydroxy-(9CI)
CAS No: 69053-50-5 Catalog No: AG00FGHU MDL No:MFCD18814453
Product Description
Catalog Number:
AG00FGHU
Chemical Name:
2H-Benzimidazol-2-one,1,3-dihydro-4-hydroxy-(9CI)
CAS Number:
69053-50-5
Molecular Formula:
C7H6N2O2
Molecular Weight:
150.1347
MDL Number:
MFCD18814453
IUPAC Name:
4-hydroxy-1,3-dihydrobenzimidazol-2-one
InChI:
InChI=1S/C7H6N2O2/c10-5-3-1-2-4-6(5)9-7(11)8-4/h1-3,10H,(H2,8,9,11)
InChI Key:
CPBGGIHYAYWNDD-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c([nH]1)cccc2O
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
150.137g/mol
Monoisotopic Mass:
150.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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