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34580-82-0 | 1H-Benzimidazole,2-(1-methoxyethyl)-(9CI)
CAS No: 34580-82-0 Catalog No: AG00CWM3 MDL No:MFCD18807527
Product Description
Catalog Number:
AG00CWM3
Chemical Name:
1H-Benzimidazole,2-(1-methoxyethyl)-(9CI)
CAS Number:
34580-82-0
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD18807527
IUPAC Name:
2-(1-methoxyethyl)-1H-benzimidazole
InChI:
InChI=1S/C10H12N2O/c1-7(13-2)10-11-8-5-3-4-6-9(8)12-10/h3-7H,1-2H3,(H,11,12)
InChI Key:
SCNIZJJJBSCYAV-UHFFFAOYSA-N
SMILES:
COC(c1nc2c([nH]1)cccc2)C
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:
37.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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