13-cis-12-(3'-Carboxyphenyl)retinoic acid
TL;DR: 13-cis-12-(3'-Carboxyphenyl)retinoic acid (CAS 141948-79-0) is a chemical compound with molecular formula C27H32O4 and molecular weight 420.23007 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(1Z,3Z,5E,7E)-1-carboxy-2,6-dimethyl-8-(2,6,6-trimethylcyclohexen-1-yl)octa-1,3,5,7-tetraen-3-yl]benzoic acid
Also Known As: 13-cis-12-(3'-Carboxyphenyl)retinoic acid, Bms 181162, NS(1) Glycoprotein, brassica campestris, 13-cis-12-(3/'-carboxyphenyl)retinoic acid, SID:163801856
Technical Specifications
| Molecular Formula | C27H32O4 |
| Molecular Weight | 420.23007 g/mol |
| XLogP | 7.3 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.23007 Da |
| Heavy Atoms | 31 |
| Complexity | 848.0 |
| SMILES | CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C(\C2=CC(=CC=C2)C(=O)O)/C(=C\C(=O)O)/C)/C |
| InChIKey | XKKDQOHDTASHCE-PAZAWXFKSA-N |
Chemical Property Profile of 13-cis-12-(3'-Carboxyphenyl)retinoic acid
Property Insights of 13-cis-12-(3'-Carboxyphenyl)retinoic acid
The XLogP value of 7.3 indicates that 13-cis-12-(3'-Carboxyphenyl)retinoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 13-cis-12-(3'-Carboxyphenyl)retinoic acid. Following Lipinski's Rule of Five, 13-cis-12-(3'-Carboxyphenyl)retinoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 13-cis-12-(3'-Carboxyphenyl)retinoic acid?
The CAS number of 13-cis-12-(3'-Carboxyphenyl)retinoic acid is 141948-79-0.
What is the molecular formula of 13-cis-12-(3'-Carboxyphenyl)retinoic acid?
The molecular formula of 13-cis-12-(3'-Carboxyphenyl)retinoic acid is C27H32O4.
What is the molecular weight of 13-cis-12-(3'-Carboxyphenyl)retinoic acid?
The molecular weight of 13-cis-12-(3'-Carboxyphenyl)retinoic acid is 420.23007 g/mol.
Where can I buy 13-cis-12-(3'-Carboxyphenyl)retinoic acid?
You can request a quote for 13-cis-12-(3'-Carboxyphenyl)retinoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 13-cis-12-(3'-Carboxyphenyl)retinoic acid?
Yes, CoreyChem provides custom synthesis services for 13-cis-12-(3'-Carboxyphenyl)retinoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.