4,4-双(3,5-二溴-4-羟基苯基)戊酸
TL;DR: 4,4-双(3,5-二溴-4-羟基苯基)戊酸 (CAS 2027-47-6) is a chemical compound with molecular formula C17H14Br4O4 and molecular weight 597.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-双(3,5-二溴-4-羟基苯基)戊酸
4,4-bis(3,5-dibromo-4-hydroxyphenyl)pentanoic acid
Also Known As: 4,4-bis(3,5-dibromo-4-hydroxyphenyl)pentanoic acid, NCIStruc1_000405, NCIStruc2_000107, (E)-2-(pent-3-en-1-yl)pyridine, NCI60_001803
| Molecular Formula | C17H14Br4O4 |
|---|---|
| Molecular Weight | 597.76 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 597.7626 |
| Heavy Atoms | 25 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 2027-47-6 |
|---|---|
| SMILES | CC(CCC(=O)O)(C1=CC(=C(C(=C1)Br)O)Br)C2=CC(=C(C(=C2)Br)O)Br |
| InChIKey | OFLOJYUEVWVCRY-UHFFFAOYSA-N |
Product Overview
4,4-双(3,5-二溴-4-羟基苯基)戊酸 (CAS 2027-47-6), with molecular formula C17H14Br4O4 and molecular weight 597.76 g/mol. IUPAC: 4,4-bis(3,5-dibromo-4-hydroxyphenyl)pentanoic acid.
Chemical Property Profile of 4,4-双(3,5-二溴-4-羟基苯基)戊酸
Property Insights of 4,4-双(3,5-二溴-4-羟基苯基)戊酸
The XLogP value of 6.1 indicates that 4,4-双(3,5-二溴-4-羟基苯基)戊酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4-双(3,5-二溴-4-羟基苯基)戊酸. Following Lipinski's Rule of Five, 4,4-双(3,5-二溴-4-羟基苯基)戊酸 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4-双(3,5-二溴-4-羟基苯基)戊酸?
The CAS number of 4,4-双(3,5-二溴-4-羟基苯基)戊酸 is 2027-47-6.
What is the molecular formula of 4,4-双(3,5-二溴-4-羟基苯基)戊酸?
The molecular formula of 4,4-双(3,5-二溴-4-羟基苯基)戊酸 is C17H14Br4O4.
What is the molecular weight of 4,4-双(3,5-二溴-4-羟基苯基)戊酸?
The molecular weight of 4,4-双(3,5-二溴-4-羟基苯基)戊酸 is 597.76 g/mol.
Where can I buy 4,4-双(3,5-二溴-4-羟基苯基)戊酸?
You can request a quote for 4,4-双(3,5-二溴-4-羟基苯基)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-双(3,5-二溴-4-羟基苯基)戊酸?
Yes, KEHONG BIO provides custom synthesis services for 4,4-双(3,5-二溴-4-羟基苯基)戊酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.