1-Chloro-3-(2-methylpropoxy)propan-2-ol
TL;DR: 1-Chloro-3-(2-methylpropoxy)propan-2-ol (CAS 42314-08-9) is a chemical compound with molecular formula C7H15ClO2 and molecular weight 166.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-3-(2-methylpropoxy)propan-2-ol
Also Known As: 1-Chloro-3-(2-methylpropoxy)propan-2-ol, 1-chloro-3-isobutoxypropan-2-ol, 1-chloro-3- propan-2-ol, NCIOpen2_001077, 1-Chloro-3-isobutoxy-2-propanol
| Molecular Formula | C7H15ClO2 |
|---|---|
| Molecular Weight | 166.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 166.07605 |
| Heavy Atoms | 10 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 42314-08-9 |
|---|---|
| SMILES | CC(C)COCC(CCl)O |
| InChIKey | OYLSNRGLWVHWNI-UHFFFAOYSA-N |
Product Overview
1-Chloro-3-(2-methylpropoxy)propan-2-ol (CAS 42314-08-9), with molecular formula C7H15ClO2 and molecular weight 166.08 g/mol. IUPAC: 1-chloro-3-(2-methylpropoxy)propan-2-ol.
Chemical Property Profile of 1-Chloro-3-(2-methylpropoxy)propan-2-ol
Property Insights of 1-Chloro-3-(2-methylpropoxy)propan-2-ol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-3-(2-methylpropoxy)propan-2-ol. With a topological polar surface area (TPSA) of 29.5 Ų, 1-Chloro-3-(2-methylpropoxy)propan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-3-(2-methylpropoxy)propan-2-ol has 1 hydrogen bond donor(s) and 2 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-(2-methylpropoxy)propan-2-ol?
The CAS number of 1-Chloro-3-(2-methylpropoxy)propan-2-ol is 42314-08-9.
What is the molecular formula of 1-Chloro-3-(2-methylpropoxy)propan-2-ol?
The molecular formula of 1-Chloro-3-(2-methylpropoxy)propan-2-ol is C7H15ClO2.
What is the molecular weight of 1-Chloro-3-(2-methylpropoxy)propan-2-ol?
The molecular weight of 1-Chloro-3-(2-methylpropoxy)propan-2-ol is 166.08 g/mol.
Where can I buy 1-Chloro-3-(2-methylpropoxy)propan-2-ol?
You can request a quote for 1-Chloro-3-(2-methylpropoxy)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-(2-methylpropoxy)propan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-3-(2-methylpropoxy)propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.