1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-
TL;DR: 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)- (CAS 63296-13-9) is a chemical compound with molecular formula C15H12O5 and molecular weight 272.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenylmethoxybenzene-1,3-dicarboxylic acid
Also Known As: 4-(Benzyloxy)isophthalic acid, 4-phenylmethoxybenzene-1,3-dicarboxylic Acid, 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-, 1,3-Benzenedicarboxylic acid,4-(phenylmethoxy)-, 4-(BENZYLOXY)BENZENE-1,3-DICARBOXYLIC ACID
| Molecular Formula | C15H12O5 |
|---|---|
| Molecular Weight | 272.07 g/mol |
| LogP | 2.662 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 272.06848 |
| Heavy Atoms | 20 |
| Complexity | 633.96704 |
Chemical Identifiers
| CAS Number | 63296-13-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(=O)O)C(=O)O |
Product Overview
1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)- (CAS 63296-13-9), with molecular formula C15H12O5 and molecular weight 272.07 g/mol. IUPAC: 4-phenylmethoxybenzene-1,3-dicarboxylic acid.
Chemical Property Profile of 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-
Property Insights of 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-
The XLogP value of 2.662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-. Following Lipinski's Rule of Five, 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)- has 2 hydrogen bond donor(s) and 3 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 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-?
The CAS number of 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)- is 63296-13-9.
What is the molecular formula of 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-?
The molecular formula of 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)- is C15H12O5.
What is the molecular weight of 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-?
The molecular weight of 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)- is 272.07 g/mol.
Where can I buy 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-?
You can request a quote for 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.