4'-氯-5-甲氧基-2-联苯乙酸
TL;DR: 4'-氯-5-甲氧基-2-联苯乙酸 (CAS 77894-12-3) 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.
4'-氯-5-甲氧基-2-联苯乙酸
2-[2-(4-chlorophenyl)-4-methoxyphenyl]acetic acid
Also Known As: 4'-Chloro-5-methoxy-2-biphenylacetic acid, 2-BIPHENYLACETIC ACID, 4'-CHLORO-5-METHOXY-, 4'-Chloro-5-methoxy-(1,1'-biphenyl)-2-acetic acid, (1,1'-Biphenyl)-2-acetic acid, 4'-chloro-5-methoxy-, 2-[2-(4-chlorophenyl)-4-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 | 77894-12-3 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)CC(=O)O)C2=CC=C(C=C2)Cl |
| InChIKey | LFULLDHQIIJCGN-UHFFFAOYSA-N |
Product Overview
4'-氯-5-甲氧基-2-联苯乙酸 (CAS 77894-12-3), with molecular formula C15H13ClO3 and molecular weight 276.06 g/mol. IUPAC: 2-[2-(4-chlorophenyl)-4-methoxyphenyl]acetic acid.
Chemical Property Profile of 4'-氯-5-甲氧基-2-联苯乙酸
Property Insights of 4'-氯-5-甲氧基-2-联苯乙酸
The XLogP value of 3.6 indicates that 4'-氯-5-甲氧基-2-联苯乙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 4'-氯-5-甲氧基-2-联苯乙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-氯-5-甲氧基-2-联苯乙酸 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 4'-氯-5-甲氧基-2-联苯乙酸?
The CAS number of 4'-氯-5-甲氧基-2-联苯乙酸 is 77894-12-3.
What is the molecular formula of 4'-氯-5-甲氧基-2-联苯乙酸?
The molecular formula of 4'-氯-5-甲氧基-2-联苯乙酸 is C15H13ClO3.
What is the molecular weight of 4'-氯-5-甲氧基-2-联苯乙酸?
The molecular weight of 4'-氯-5-甲氧基-2-联苯乙酸 is 276.06 g/mol.
Where can I buy 4'-氯-5-甲氧基-2-联苯乙酸?
You can request a quote for 4'-氯-5-甲氧基-2-联苯乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-氯-5-甲氧基-2-联苯乙酸?
Yes, KEHONG BIO provides custom synthesis services for 4'-氯-5-甲氧基-2-联苯乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.