3-氯苯甲醇
TL;DR: 3-氯苯甲醇 (CAS 873-63-2) is a chemical compound with molecular formula C7H7ClO and molecular weight 142.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氯苯甲醇
(3-chlorophenyl)methanol
Also Known As: 3-Chlorobenzyl alcohol, (3-Chlorophenyl)methanol, m-Chlorobenzyl alcohol, 3-chlorobenzylalcohol, Benzenemethanol, 3-chloro-
| Molecular Formula | C7H7ClO |
|---|---|
| Molecular Weight | 142.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.01854 |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
Chemical Identifiers
| CAS Number | 873-63-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)CO |
| InChIKey | ZSRDNPVYGSFUMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-氯苯甲醇 (CAS 873-63-2), with molecular formula C7H7ClO and molecular weight 142.02 g/mol. IUPAC: (3-chlorophenyl)methanol.
Chemical Property Profile of 3-氯苯甲醇
Property Insights of 3-氯苯甲醇
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-氯苯甲醇. With a topological polar surface area (TPSA) of 20.2 Ų, 3-氯苯甲醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-氯苯甲醇 has 1 hydrogen bond donor(s) and 1 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 3-氯苯甲醇?
The CAS number of 3-氯苯甲醇 is 873-63-2.
What is the molecular formula of 3-氯苯甲醇?
The molecular formula of 3-氯苯甲醇 is C7H7ClO.
What is the molecular weight of 3-氯苯甲醇?
The molecular weight of 3-氯苯甲醇 is 142.02 g/mol.
Where can I buy 3-氯苯甲醇?
You can request a quote for 3-氯苯甲醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氯苯甲醇?
Yes, KEHONG BIO provides custom synthesis services for 3-氯苯甲醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.