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Home > Imidazoles > 953857-84-6
953857-84-6 | 1-(4-METHYL-1H-BENZIMIDAZOL-2-YL)ETHANOL
CAS No: 953857-84-6 Catalog No: AG00658V MDL No:MFCD09880340
Product Description
Catalog Number:
AG00658V
Chemical Name:
1-(4-METHYL-1H-BENZIMIDAZOL-2-YL)ETHANOL
CAS Number:
953857-84-6
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD09880340
IUPAC Name:
1-(4-methyl-1H-benzimidazol-2-yl)ethanol
InChI:
InChI=1S/C10H12N2O/c1-6-4-3-5-8-9(6)12-10(11-8)7(2)13/h3-5,7,13H,1-2H3,(H,11,12)
InChI Key:
GTSGFORZWHBFHR-UHFFFAOYSA-N
SMILES:
CC(c1nc2c([nH]1)cccc2C)O
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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