2-苯基甘油酸
TL;DR: 2-苯基甘油酸 (CAS 5693-97-0) is a chemical compound with molecular formula C9H10O4 and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-苯基甘油酸
2,3-dihydroxy-2-phenylpropanoic acid
Also Known As: 2-Phenylglyceric acid, Anisodinic acid, 2-phenylglycericacid, Hydroxyphenyllactic acid, alpha-hydroxytropic acid
| Molecular Formula | C9H10O4 |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.0579 |
| Heavy Atoms | 13 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 5693-97-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CO)(C(=O)O)O |
| InChIKey | IWEPXSFVSUOTLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-苯基甘油酸 (CAS 5693-97-0), with molecular formula C9H10O4 and molecular weight 182.06 g/mol. IUPAC: 2,3-dihydroxy-2-phenylpropanoic acid.
Chemical Property Profile of 2-苯基甘油酸
Property Insights of 2-苯基甘油酸
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-苯基甘油酸. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-苯基甘油酸. Following Lipinski's Rule of Five, 2-苯基甘油酸 has 3 hydrogen bond donor(s) and 4 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 2-苯基甘油酸?
The CAS number of 2-苯基甘油酸 is 5693-97-0.
What is the molecular formula of 2-苯基甘油酸?
The molecular formula of 2-苯基甘油酸 is C9H10O4.
What is the molecular weight of 2-苯基甘油酸?
The molecular weight of 2-苯基甘油酸 is 182.06 g/mol.
Where can I buy 2-苯基甘油酸?
You can request a quote for 2-苯基甘油酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-苯基甘油酸?
Yes, KEHONG BIO provides custom synthesis services for 2-苯基甘油酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.