氯丙嗪
TL;DR: 氯丙嗪 (CAS 104-29-0) is a chemical compound with molecular formula C9H11ClO3 and molecular weight 202.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯丙嗪
3-(4-chlorophenoxy)propane-1,2-diol
Also Known As: chlorphenesin, Chlorophenesin, 3-(4-Chlorophenoxy)-1,2-propanediol, Chlorphenesinum, Adermykon
| Molecular Formula | C9H11ClO3 |
|---|---|
| Molecular Weight | 202.04 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 202.03967 |
| Heavy Atoms | 13 |
| Complexity | 135.0 |
| Melting Point | 86–92 |
| Solubility | 10000 |
Chemical Identifiers
| CAS Number | 104-29-0 |
|---|---|
| SMILES | C1=CC(=CC=C1OCC(CO)O)Cl |
| InChIKey | MXOAEAUPQDYUQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯丙嗪 (CAS 104-29-0), with molecular formula C9H11ClO3 and molecular weight 202.04 g/mol. IUPAC: 3-(4-chlorophenoxy)propane-1,2-diol.
Chemical Property Profile of 氯丙嗪
Property Insights of 氯丙嗪
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氯丙嗪. With a topological polar surface area (TPSA) of 49.7 Ų, 氯丙嗪 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯丙嗪 has 2 hydrogen bond donor(s) and 3 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 氯丙嗪?
The CAS number of 氯丙嗪 is 104-29-0.
What is the molecular formula of 氯丙嗪?
The molecular formula of 氯丙嗪 is C9H11ClO3.
What is the molecular weight of 氯丙嗪?
The molecular weight of 氯丙嗪 is 202.04 g/mol.
Where can I buy 氯丙嗪?
You can request a quote for 氯丙嗪 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯丙嗪?
Yes, KEHONG BIO provides custom synthesis services for 氯丙嗪 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.