1-氯-3-(癸氧基)-2-丙醇
TL;DR: 1-氯-3-(癸氧基)-2-丙醇 (CAS 18371-72-7) is a chemical compound with molecular formula C13H27ClO2 and molecular weight 250.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-氯-3-(癸氧基)-2-丙醇
1-chloro-3-decoxypropan-2-ol
Also Known As: 1-chloro-3-decoxypropan-2-ol, 2-Propanol, 1-chloro-3-(decyloxy)-, 1-chloro-3-(decyloxy)propan-2-ol, 1-Chloro-3-(decyloxy)-2-propanol, 1-chloro-3-decyloxy-2-propanol
| Molecular Formula | C13H27ClO2 |
|---|---|
| Molecular Weight | 250.17 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 250.16995 |
| Heavy Atoms | 16 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 18371-72-7 |
|---|---|
| SMILES | CCCCCCCCCCOCC(CCl)O |
| InChIKey | YIEWJUDIKXQGKF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-氯-3-(癸氧基)-2-丙醇 (CAS 18371-72-7), with molecular formula C13H27ClO2 and molecular weight 250.17 g/mol. IUPAC: 1-chloro-3-decoxypropan-2-ol.
Chemical Property Profile of 1-氯-3-(癸氧基)-2-丙醇
Property Insights of 1-氯-3-(癸氧基)-2-丙醇
The XLogP value of 4.6 indicates that 1-氯-3-(癸氧基)-2-丙醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 1-氯-3-(癸氧基)-2-丙醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-氯-3-(癸氧基)-2-丙醇 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-氯-3-(癸氧基)-2-丙醇?
The CAS number of 1-氯-3-(癸氧基)-2-丙醇 is 18371-72-7.
What is the molecular formula of 1-氯-3-(癸氧基)-2-丙醇?
The molecular formula of 1-氯-3-(癸氧基)-2-丙醇 is C13H27ClO2.
What is the molecular weight of 1-氯-3-(癸氧基)-2-丙醇?
The molecular weight of 1-氯-3-(癸氧基)-2-丙醇 is 250.17 g/mol.
Where can I buy 1-氯-3-(癸氧基)-2-丙醇?
You can request a quote for 1-氯-3-(癸氧基)-2-丙醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-氯-3-(癸氧基)-2-丙醇?
Yes, KEHONG BIO provides custom synthesis services for 1-氯-3-(癸氧基)-2-丙醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.