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4946-08-1 | 1H-Benzimidazole-1-ethanol,2-methyl-(9CI)
CAS No: 4946-08-1 Catalog No: AG00DCSL MDL No:MFCD00022844
Product Description
Catalog Number:
AG00DCSL
Chemical Name:
1H-Benzimidazole-1-ethanol,2-methyl-(9CI)
CAS Number:
4946-08-1
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD00022844
IUPAC Name:
2-(2-methylbenzimidazol-1-yl)ethanol
InChI:
InChI=1S/C10H12N2O/c1-8-11-9-4-2-3-5-10(9)12(8)6-7-13/h2-5,13H,6-7H2,1H3
InChI Key:
CURPBJGJXFWNMF-UHFFFAOYSA-N
SMILES:
OCCn1c(C)nc2c1cccc2
Properties
Complexity:
174
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:
1
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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