4-(2,3-二羟基丙氧基)苯甲酸
TL;DR: 4-(2,3-二羟基丙氧基)苯甲酸 (CAS 4180-57-8) is a chemical compound with molecular formula C10H12O5 and molecular weight 212.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,3-二羟基丙氧基)苯甲酸
4-(2,3-dihydroxypropoxy)benzoic acid
Also Known As: 4-(2,3-dihydroxypropoxy)benzoic acid, 4- BENZOICACID, p-(2,3-Dihydroxypropoxy)benzoic acid, 3-(p-Carboxyphenoxy)-1,2-propanediol, Benzoic acid, 4-(2,3-dihydroxypropoxy)-
| Molecular Formula | C10H12O5 |
|---|---|
| Molecular Weight | 212.07 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.06847 |
| Heavy Atoms | 15 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 4180-57-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)OCC(CO)O |
| InChIKey | KHVXZWBZADAAPR-UHFFFAOYSA-N |
Product Overview
4-(2,3-二羟基丙氧基)苯甲酸 (CAS 4180-57-8), with molecular formula C10H12O5 and molecular weight 212.07 g/mol. IUPAC: 4-(2,3-dihydroxypropoxy)benzoic acid.
Chemical Property Profile of 4-(2,3-二羟基丙氧基)苯甲酸
Property Insights of 4-(2,3-二羟基丙氧基)苯甲酸
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2,3-二羟基丙氧基)苯甲酸. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2,3-二羟基丙氧基)苯甲酸. Following Lipinski's Rule of Five, 4-(2,3-二羟基丙氧基)苯甲酸 has 3 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 4-(2,3-二羟基丙氧基)苯甲酸?
The CAS number of 4-(2,3-二羟基丙氧基)苯甲酸 is 4180-57-8.
What is the molecular formula of 4-(2,3-二羟基丙氧基)苯甲酸?
The molecular formula of 4-(2,3-二羟基丙氧基)苯甲酸 is C10H12O5.
What is the molecular weight of 4-(2,3-二羟基丙氧基)苯甲酸?
The molecular weight of 4-(2,3-二羟基丙氧基)苯甲酸 is 212.07 g/mol.
Where can I buy 4-(2,3-二羟基丙氧基)苯甲酸?
You can request a quote for 4-(2,3-二羟基丙氧基)苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2,3-二羟基丙氧基)苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-(2,3-二羟基丙氧基)苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.