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53953-47-2 | 1H-Benzimidazole-1-propanol(9CI)
CAS No: 53953-47-2 Catalog No: AG00DWKH MDL No:MFCD12186759
Product Description
Catalog Number:
AG00DWKH
Chemical Name:
1H-Benzimidazole-1-propanol(9CI)
CAS Number:
53953-47-2
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD12186759
IUPAC Name:
3-(benzimidazol-1-yl)propan-1-ol
InChI:
InChI=1S/C10H12N2O/c13-7-3-6-12-8-11-9-4-1-2-5-10(9)12/h1-2,4-5,8,13H,3,6-7H2
InChI Key:
MCUSVJQHGDUXFV-UHFFFAOYSA-N
SMILES:
OCCCn1cnc2c1cccc2
Properties
Complexity:
163
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:
3
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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