Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester
TL;DR: Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester (CAS 67032-33-1) is a chemical compound with molecular formula C11H14O5 and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(2,3-dihydroxypropoxy)benzoate
Also Known As: starbld0025255, methyl 3-(2,3-dihydroxypropoxy)benzoate, BENZOIC ACID, m-(2,3-DIHYDROXYPROPOXY)-, METHYL ESTER, m-(2,3-Dihydroxypropoxy)benzoic acid methyl ester, methyl 3-(2,3-dihydoxypropyloxy)benzoate
| Molecular Formula | C11H14O5 |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 226.08412 |
| Heavy Atoms | 16 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 67032-33-1 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC=C1)OCC(CO)O |
| InChIKey | APZIDRCACRTPAG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester (CAS 67032-33-1), with molecular formula C11H14O5 and molecular weight 226.08 g/mol. IUPAC: methyl 3-(2,3-dihydroxypropoxy)benzoate.
Chemical Property Profile of Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester
Property Insights of Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester. Following Lipinski's Rule of Five, Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester has 2 hydrogen bond donor(s) and 5 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 Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester?
The CAS number of Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester is 67032-33-1.
What is the molecular formula of Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester?
The molecular formula of Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester is C11H14O5.
What is the molecular weight of Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester?
The molecular weight of Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester is 226.08 g/mol.
Where can I buy Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester?
You can request a quote for Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, m-(2,3-dihydroxypropoxy)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.