2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-
TL;DR: 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- (CAS 85514-32-5) is a chemical compound with molecular formula C6H7ClO2 and molecular weight 146.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z,4Z)-3-chlorohexa-2,4-dienoic acid
Also Known As: 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-, (2Z,4Z)-3-chlorohexa-2,4-dienoic acid
| Molecular Formula | C6H7ClO2 |
|---|---|
| Molecular Weight | 146.01 g/mol |
| LogP | 1.7698 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 146.01346 |
| Heavy Atoms | 9 |
| Complexity | 158.4408 |
Chemical Identifiers
| CAS Number | 85514-32-5 |
|---|---|
| SMILES | C/C=C\C(=C\C(=O)O)\Cl |
Product Overview
2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- (CAS 85514-32-5), with molecular formula C6H7ClO2 and molecular weight 146.01 g/mol. IUPAC: (2Z,4Z)-3-chlorohexa-2,4-dienoic acid.
Chemical Property Profile of 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-
Property Insights of 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-
The XLogP value of 1.7698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-. With a topological polar surface area (TPSA) of 37.3 Ų, 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- has 1 hydrogen bond donor(s) and 1 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 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-?
The CAS number of 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- is 85514-32-5.
What is the molecular formula of 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-?
The molecular formula of 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- is C6H7ClO2.
What is the molecular weight of 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-?
The molecular weight of 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- is 146.01 g/mol.
Where can I buy 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-?
You can request a quote for 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Hexadienoic acid, 3-chloro-, (Z,Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.