1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-
TL;DR: 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- (CAS 87171-17-3) is a chemical compound with molecular formula C9H12O4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-1-(4-hydroxy-3-methoxyphenyl)ethane-1,2-diol
Also Known As: Vanylglycol, Lopac-H-1377, (+)-4-Hydroxy-3-methoxyphenylglycol, 3-Methoxy-4-hydroxyphenylglycol, (+)-, (+)-3-methoxy-4-hydroxyphenylglycol
| Molecular Formula | C9H12O4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.07356 |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 87171-17-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[C@@H](CO)O)O |
| InChIKey | FBWPWWWZWKPJFL-MRVPVSSYSA-N |
Product Overview
1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- (CAS 87171-17-3), with molecular formula C9H12O4 and molecular weight 184.07 g/mol. IUPAC: (1S)-1-(4-hydroxy-3-methoxyphenyl)ethane-1,2-diol.
Chemical Property Profile of 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-
Property Insights of 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-
The XLogP value of -0.7 indicates that 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-. Following Lipinski's Rule of Five, 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- 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 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-?
The CAS number of 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- is 87171-17-3.
What is the molecular formula of 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-?
The molecular formula of 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- is C9H12O4.
What is the molecular weight of 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-?
The molecular weight of 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- is 184.07 g/mol.
Where can I buy 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-?
You can request a quote for 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Ethanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (1S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.