1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol
TL;DR: 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol (CAS 126930-66-3) is a chemical compound with molecular formula C10H10ClN3O3 and molecular weight 255.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-3-(6-nitrobenzimidazol-1-yl)propan-2-ol
Also Known As: alpha-(Chloromethyl)-6-nitro-1H-benzimidazole-1-ethanol, 1-chloro-3-(6-nitrobenzimidazol-1-yl)propan-2-ol, 1H-Benzimidazole-1-ethanol, alpha-(chloromethyl)-6-nitro-, 6-Nitro-1-(beta-hydroksy-gamma-chloropropylo)benzimidazol, 6-Nitro-1-(beta-hydroksy-gamma-chloropropylo)benzimidazol [Polish]
| Molecular Formula | C10H10ClN3O3 |
|---|---|
| Molecular Weight | 255.04 g/mol |
| LogP | 1.5442 |
| Topological Polar Surface Area | 81.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.04106 |
| Heavy Atoms | 17 |
| Complexity | 554.7197 |
Chemical Identifiers
| CAS Number | 126930-66-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])N(C=N2)CC(CCl)O |
Product Overview
1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol (CAS 126930-66-3), with molecular formula C10H10ClN3O3 and molecular weight 255.04 g/mol. IUPAC: 1-chloro-3-(6-nitrobenzimidazol-1-yl)propan-2-ol.
Chemical Property Profile of 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol
Property Insights of 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol
The XLogP value of 1.5442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol. The TPSA of 81.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol. Following Lipinski's Rule of Five, 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol?
The CAS number of 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol is 126930-66-3.
What is the molecular formula of 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol?
The molecular formula of 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol is C10H10ClN3O3.
What is the molecular weight of 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol?
The molecular weight of 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol is 255.04 g/mol.
Where can I buy 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol?
You can request a quote for 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-3-(6-nitro-1H-benzimidazol-1-yl)propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.