4-(4-溴苯基)戊酸
TL;DR: 4-(4-溴苯基)戊酸 (CAS 31042-07-6) is a chemical compound with molecular formula C11H13BrO2 and molecular weight 256.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-溴苯基)戊酸
4-(4-bromophenyl)pentanoic acid
Also Known As: 4-(4-Bromophenyl)pentanoic acid, 4-(p-Bromophenyl)valeric acid, 4-(4-Bromophenyl)valeric acid, NCI60_007976, J1.415.670D
| Molecular Formula | C11H13BrO2 |
|---|---|
| Molecular Weight | 256.01 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.0099 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 31042-07-6 |
|---|---|
| SMILES | CC(CCC(=O)O)C1=CC=C(C=C1)Br |
| InChIKey | UCJNBCAEPJOHDL-UHFFFAOYSA-N |
Product Overview
4-(4-溴苯基)戊酸 (CAS 31042-07-6), with molecular formula C11H13BrO2 and molecular weight 256.01 g/mol. IUPAC: 4-(4-bromophenyl)pentanoic acid.
Chemical Property Profile of 4-(4-溴苯基)戊酸
Property Insights of 4-(4-溴苯基)戊酸
The XLogP value of 3.1 indicates that 4-(4-溴苯基)戊酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-(4-溴苯基)戊酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-溴苯基)戊酸 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 4-(4-溴苯基)戊酸?
The CAS number of 4-(4-溴苯基)戊酸 is 31042-07-6.
What is the molecular formula of 4-(4-溴苯基)戊酸?
The molecular formula of 4-(4-溴苯基)戊酸 is C11H13BrO2.
What is the molecular weight of 4-(4-溴苯基)戊酸?
The molecular weight of 4-(4-溴苯基)戊酸 is 256.01 g/mol.
Where can I buy 4-(4-溴苯基)戊酸?
You can request a quote for 4-(4-溴苯基)戊酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-溴苯基)戊酸?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-溴苯基)戊酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.