3,4-二羟基苄醇
TL;DR: 3,4-二羟基苄醇 (CAS 3897-89-0) is a chemical compound with molecular formula C7H8O3 and molecular weight 140.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-二羟基苄醇
4-(hydroxymethyl)benzene-1,2-diol
Also Known As: 3,4-Dihydroxybenzyl alcohol, 4-(hydroxymethyl)benzene-1,2-diol, 4-Hydroxymethylcatechol, Isoprenaline, Protocatechuic alcohol
| Molecular Formula | C7H8O3 |
|---|---|
| Molecular Weight | 140.05 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.04735 |
| Heavy Atoms | 10 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 3897-89-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1CO)O)O |
| InChIKey | PCYGLFXKCBFGPC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-二羟基苄醇 (CAS 3897-89-0), with molecular formula C7H8O3 and molecular weight 140.05 g/mol. IUPAC: 4-(hydroxymethyl)benzene-1,2-diol.
Chemical Property Profile of 3,4-二羟基苄醇
Property Insights of 3,4-二羟基苄醇
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-二羟基苄醇. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-二羟基苄醇. Following Lipinski's Rule of Five, 3,4-二羟基苄醇 has 3 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 3,4-二羟基苄醇?
The CAS number of 3,4-二羟基苄醇 is 3897-89-0.
What is the molecular formula of 3,4-二羟基苄醇?
The molecular formula of 3,4-二羟基苄醇 is C7H8O3.
What is the molecular weight of 3,4-二羟基苄醇?
The molecular weight of 3,4-二羟基苄醇 is 140.05 g/mol.
Where can I buy 3,4-二羟基苄醇?
You can request a quote for 3,4-二羟基苄醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-二羟基苄醇?
Yes, KEHONG BIO provides custom synthesis services for 3,4-二羟基苄醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.