苯甲二醇
TL;DR: 苯甲二醇 (CAS 4403-72-9) is a chemical compound with molecular formula C7H8O2 and molecular weight 124.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯甲二醇
phenylmethanediol
Also Known As: Phenylmethanediol, Methanediol, phenyl-, 1-Phenylmethanediol, hydroxybenzyl alcohol, monohydroxyl benzyl alcohol
| Molecular Formula | C7H8O2 |
|---|---|
| Molecular Weight | 124.05 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 124.05243 |
| Heavy Atoms | 9 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 4403-72-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(O)O |
| InChIKey | SNGARVZXPNQWEY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯甲二醇 (CAS 4403-72-9), with molecular formula C7H8O2 and molecular weight 124.05 g/mol. IUPAC: phenylmethanediol.
Chemical Property Profile of 苯甲二醇
Property Insights of 苯甲二醇
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯甲二醇. With a topological polar surface area (TPSA) of 40.5 Ų, 苯甲二醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯甲二醇 has 2 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 苯甲二醇?
The CAS number of 苯甲二醇 is 4403-72-9.
What is the molecular formula of 苯甲二醇?
The molecular formula of 苯甲二醇 is C7H8O2.
What is the molecular weight of 苯甲二醇?
The molecular weight of 苯甲二醇 is 124.05 g/mol.
Where can I buy 苯甲二醇?
You can request a quote for 苯甲二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯甲二醇?
Yes, KEHONG BIO provides custom synthesis services for 苯甲二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.