3-Biphenylacetic acid, 4'-chloro-4-methoxy-
TL;DR: 3-Biphenylacetic acid, 4'-chloro-4-methoxy- (CAS 77894-08-7) is a chemical compound with molecular formula C15H13ClO3 and molecular weight 276.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(4-chlorophenyl)-2-methoxyphenyl]acetic acid
Also Known As: 4'-Chloro-4-methoxy-3-biphenylacetic acid, 3-BIPHENYLACETIC ACID, 4'-CHLORO-4-METHOXY-, 4'-Chloro-4-methoxy-(1,1'-biphenyl)-3-acetic acid, (1,1'-Biphenyl)-3-acetic acid, 4'-chloro-4-methoxy-, 2-[5-(4-chlorophenyl)-2-methoxyphenyl]acetic acid
| Molecular Formula | C15H13ClO3 |
|---|---|
| Molecular Weight | 276.06 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.05533 |
| Heavy Atoms | 19 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 77894-08-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CC=C(C=C2)Cl)CC(=O)O |
| InChIKey | XJQBKQUXUQRYJO-UHFFFAOYSA-N |
Product Overview
3-Biphenylacetic acid, 4'-chloro-4-methoxy- (CAS 77894-08-7), with molecular formula C15H13ClO3 and molecular weight 276.06 g/mol. IUPAC: 2-[5-(4-chlorophenyl)-2-methoxyphenyl]acetic acid.
Chemical Property Profile of 3-Biphenylacetic acid, 4'-chloro-4-methoxy-
Property Insights of 3-Biphenylacetic acid, 4'-chloro-4-methoxy-
The XLogP value of 3.6 indicates that 3-Biphenylacetic acid, 4'-chloro-4-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 3-Biphenylacetic acid, 4'-chloro-4-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Biphenylacetic acid, 4'-chloro-4-methoxy- has 1 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 3-Biphenylacetic acid, 4'-chloro-4-methoxy-?
The CAS number of 3-Biphenylacetic acid, 4'-chloro-4-methoxy- is 77894-08-7.
What is the molecular formula of 3-Biphenylacetic acid, 4'-chloro-4-methoxy-?
The molecular formula of 3-Biphenylacetic acid, 4'-chloro-4-methoxy- is C15H13ClO3.
What is the molecular weight of 3-Biphenylacetic acid, 4'-chloro-4-methoxy-?
The molecular weight of 3-Biphenylacetic acid, 4'-chloro-4-methoxy- is 276.06 g/mol.
Where can I buy 3-Biphenylacetic acid, 4'-chloro-4-methoxy-?
You can request a quote for 3-Biphenylacetic acid, 4'-chloro-4-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Biphenylacetic acid, 4'-chloro-4-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for 3-Biphenylacetic acid, 4'-chloro-4-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.