4-Chloro-2-(hydroxymethyl)benzimidazole - CAS 1263060-13-4
Catalog: |
BB006557 |
Product Name: |
4-Chloro-2-(hydroxymethyl)benzimidazole |
CAS: |
1263060-13-4 |
Synonyms: |
(4-chloro-1H-benzimidazol-2-yl)methanol; (4-chloro-1H-benzimidazol-2-yl)methanol |
IUPAC Name: | (4-chloro-1H-benzimidazol-2-yl)methanol |
Description: | 4-Chloro-2-(hydroxymethyl)benzimidazole (CAS# 1263060-13-4) is a useful research chemical. |
Molecular Weight: | 182.61 |
Molecular Formula: | C8H7ClN2O |
Canonical SMILES: | C1=CC2=C(C(=C1)Cl)N=C(N2)CO |
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 |
LogP: | 1.70860 |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.0246905 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.0246905 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 48.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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