4-Bromo-2-(hydroxymethyl)benzimidazole - CAS 1248566-21-3
Catalog: |
BB006006 |
Product Name: |
4-Bromo-2-(hydroxymethyl)benzimidazole |
CAS: |
1248566-21-3 |
Synonyms: |
(4-bromo-1H-benzimidazol-2-yl)methanol; (4-bromo-1H-benzimidazol-2-yl)methanol |
IUPAC Name: | (4-bromo-1H-benzimidazol-2-yl)methanol |
Description: | 4-Bromo-2-(hydroxymethyl)benzimidazole (CAS# 1248566-21-3 ) is a useful research chemical. |
Molecular Weight: | 227.06 |
Molecular Formula: | C8H7BrN2O |
Canonical SMILES: | C1=CC2=C(C(=C1)Br)N=C(N2)CO |
InChI: | InChI=1S/C8H7BrN2O/c9-5-2-1-3-6-8(5)11-7(4-12)10-6/h1-3,12H,4H2,(H,10,11) |
InChI Key: | MKWHLNKGLAEXPR-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
US-2020255414-A1 | Cxcr4 inhibitors and uses thereof | 20160621 |
US-10988465-B2 | CXCR4 inhibitors and uses thereof | 20160621 |
WO-2008016288-A1 | Benzimidazo[1,2-c][1,2,3]thiadiazol-7-sulfonamides as inhibitors of carbonic anhydrase and the intermediates for production thereof | 20060802 |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.97418 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.97418 |
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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