1,2,3,4-四氢菲-9-甲酸
TL;DR: 1,2,3,4-四氢菲-9-甲酸 (CAS 102630-80-8) is a chemical compound with molecular formula C15H14O2 and molecular weight 226.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-四氢菲-9-甲酸
1,2,3,4-tetrahydrophenanthrene-9-carboxylic acid
Also Known As: KST-1A9613, 1,2,3,4-tetrahydrophenanthrene-9-carboxylic acid, 9-Phenanthrenecarboxylicacid, 1,2,3,4-tetrahydro-
| Molecular Formula | C15H14O2 |
|---|---|
| Molecular Weight | 226.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.09938 |
| Heavy Atoms | 17 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 102630-80-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C=C(C3=CC=CC=C23)C(=O)O |
| InChIKey | GWLABGLYXTZVSE-UHFFFAOYSA-N |
Product Overview
1,2,3,4-四氢菲-9-甲酸 (CAS 102630-80-8), with molecular formula C15H14O2 and molecular weight 226.10 g/mol. IUPAC: 1,2,3,4-tetrahydrophenanthrene-9-carboxylic acid.
Chemical Property Profile of 1,2,3,4-四氢菲-9-甲酸
Property Insights of 1,2,3,4-四氢菲-9-甲酸
The XLogP value of 4.1 indicates that 1,2,3,4-四氢菲-9-甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1,2,3,4-四氢菲-9-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-四氢菲-9-甲酸 has 1 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 1,2,3,4-四氢菲-9-甲酸?
The CAS number of 1,2,3,4-四氢菲-9-甲酸 is 102630-80-8.
What is the molecular formula of 1,2,3,4-四氢菲-9-甲酸?
The molecular formula of 1,2,3,4-四氢菲-9-甲酸 is C15H14O2.
What is the molecular weight of 1,2,3,4-四氢菲-9-甲酸?
The molecular weight of 1,2,3,4-四氢菲-9-甲酸 is 226.10 g/mol.
Where can I buy 1,2,3,4-四氢菲-9-甲酸?
You can request a quote for 1,2,3,4-四氢菲-9-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-四氢菲-9-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-四氢菲-9-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.