Benzoic acid, 4-(3-hydroxypropyl)-
TL;DR: Benzoic acid, 4-(3-hydroxypropyl)- (CAS 58810-87-0) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-hydroxypropyl)benzoic acid
Also Known As: 4-(3-Hydroxypropyl)benzoic acid, Benzoic acid, 4-(3-hydroxypropyl)-, 4-Hydroxypropylbenzoic acid, (Hydroxy-3 propyl)-4 benzoic acid, 4-(3-Hydroxypropyl)benzoicacid
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 1.3097 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 276.72626 |
Chemical Identifiers
| CAS Number | 58810-87-0 |
|---|---|
| SMILES | C1=CC(=CC=C1CCCO)C(=O)O |
Product Overview
Benzoic acid, 4-(3-hydroxypropyl)- (CAS 58810-87-0), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: 4-(3-hydroxypropyl)benzoic acid.
Chemical Property Profile of Benzoic acid, 4-(3-hydroxypropyl)-
Property Insights of Benzoic acid, 4-(3-hydroxypropyl)-
The XLogP value of 1.3097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 4-(3-hydroxypropyl)-. With a topological polar surface area (TPSA) of 57.53 Ų, Benzoic acid, 4-(3-hydroxypropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-(3-hydroxypropyl)- 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 Benzoic acid, 4-(3-hydroxypropyl)-?
The CAS number of Benzoic acid, 4-(3-hydroxypropyl)- is 58810-87-0.
What is the molecular formula of Benzoic acid, 4-(3-hydroxypropyl)-?
The molecular formula of Benzoic acid, 4-(3-hydroxypropyl)- is C10H12O3.
What is the molecular weight of Benzoic acid, 4-(3-hydroxypropyl)-?
The molecular weight of Benzoic acid, 4-(3-hydroxypropyl)- is 180.08 g/mol.
Where can I buy Benzoic acid, 4-(3-hydroxypropyl)-?
You can request a quote for Benzoic acid, 4-(3-hydroxypropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-(3-hydroxypropyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-(3-hydroxypropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.