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15788-11-1 | 1H-Benzimidazole-6-ethanol
CAS No: 15788-11-1 Catalog No: AG001PSY MDL No:
Product Description
Catalog Number:
AG001PSY
Chemical Name:
1H-Benzimidazole-6-ethanol
CAS Number:
15788-11-1
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
IUPAC Name:
2-(3H-benzimidazol-5-yl)ethanol
InChI:
InChI=1S/C9H10N2O/c12-4-3-7-1-2-8-9(5-7)11-6-10-8/h1-2,5-6,12H,3-4H2,(H,10,11)
InChI Key:
BJIGOPZZEFXJDI-UHFFFAOYSA-N
SMILES:
OCCc1ccc2c(c1)[nH]cn2
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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