1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol
TL;DR: 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol (CAS 439142-15-1) is a chemical compound with molecular formula C15H14ClN3O2 and molecular weight 303.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol
Also Known As: 1-(benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol, 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol, 1-(1H-benzo[d][1,2,3]triazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol
| Molecular Formula | C15H14ClN3O2 |
|---|---|
| Molecular Weight | 303.08 g/mol |
| LogP | 2.5246 |
| Topological Polar Surface Area | 60.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.07745 |
| Heavy Atoms | 21 |
| Complexity | 727.12177 |
Chemical Identifiers
| CAS Number | 439142-15-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2CC(COC3=CC=C(C=C3)Cl)O |
Product Overview
1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol (CAS 439142-15-1), with molecular formula C15H14ClN3O2 and molecular weight 303.08 g/mol. IUPAC: 1-(benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol.
Chemical Property Profile of 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol
Property Insights of 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol
The XLogP value of 2.5246 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol. The TPSA of 60.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol. Following Lipinski's Rule of Five, 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)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-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol?
The CAS number of 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol is 439142-15-1.
What is the molecular formula of 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol?
The molecular formula of 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol is C15H14ClN3O2.
What is the molecular weight of 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol?
The molecular weight of 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol is 303.08 g/mol.
Where can I buy 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol?
You can request a quote for 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)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-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-benzotriazol-1-yl)-3-(4-chlorophenoxy)propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.