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1263060-13-4

1263060-13-4 | 1H-Benzimidazole-2-methanol, 7-chloro-

CAS No: 1263060-13-4 Catalog No: AG000SJ1 MDL No:MFCD20763992

Product Description

Catalog Number:
AG000SJ1
Chemical Name:
1H-Benzimidazole-2-methanol, 7-chloro-
CAS Number:
1263060-13-4
Molecular Formula:
C8H7ClN2O
Molecular Weight:
182.6070
MDL Number:
MFCD20763992
IUPAC Name:
(4-chloro-1H-benzimidazol-2-yl)methanol
InChI:
InChI=1S/C8H7ClN2O/c9-5-2-1-3-6-8(5)11-7(4-12)10-6/h1-3,12H,4H2,(H,10,11)
InChI Key:
WBKBWIRLLDGNTK-UHFFFAOYSA-N
SMILES:
OCc1nc2c([nH]1)c(Cl)ccc2

Properties

Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.025g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
182.607g/mol
Monoisotopic Mass:
182.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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