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6340-03-0 | 1H-Benzimidazole-1-ethanol(9CI)
CAS No: 6340-03-0 Catalog No: AG00EE0K MDL No:MFCD00483391
Product Description
Catalog Number:
AG00EE0K
Chemical Name:
1H-Benzimidazole-1-ethanol(9CI)
CAS Number:
6340-03-0
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD00483391
IUPAC Name:
2-(benzimidazol-1-yl)ethanol
InChI:
InChI=1S/C9H10N2O/c12-6-5-11-7-10-8-3-1-2-4-9(8)11/h1-4,7,12H,5-6H2
InChI Key:
DJRLXHBFATVHJX-UHFFFAOYSA-N
SMILES:
OCCn1cnc2c1cccc2
NSC Number:
20761
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:
1
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Synthesis and aqueous chemistry of alpha-acetoxy-N-nitrosomorpholine: reactive intermediates and products. | The Journal of organic chemistry 20060106 |
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