2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-
TL;DR: 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- (CAS 63623-06-3) is a chemical compound with molecular formula C9H12O3 and molecular weight 168.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxiran-2-ylmethyl hexa-2,4-dienoate
Also Known As: glycidyl sorbate, Glycidyl sorbate, (+/-)-, (Oxiran-2-yl)methyl hexa-2,4-dienoate, 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-, 2,4-Hexadienoic acid, oxiranylmethyl ester, (2E,4E)-
| Molecular Formula | C9H12O3 |
|---|---|
| Molecular Weight | 168.08 g/mol |
| LogP | 1.0607 |
| Topological Polar Surface Area | 38.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.07864 |
| Heavy Atoms | 12 |
| Complexity | 201.81918 |
Chemical Identifiers
| CAS Number | 63623-06-3 |
|---|---|
| SMILES | CC=CC=CC(=O)OCC1CO1 |
Product Overview
2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- (CAS 63623-06-3), with molecular formula C9H12O3 and molecular weight 168.08 g/mol. IUPAC: oxiran-2-ylmethyl hexa-2,4-dienoate.
Chemical Property Profile of 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-
Property Insights of 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-
The XLogP value of 1.0607 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-. With a topological polar surface area (TPSA) of 38.83 Ų, 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- has 0 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 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-?
The CAS number of 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- is 63623-06-3.
What is the molecular formula of 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-?
The molecular formula of 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- is C9H12O3.
What is the molecular weight of 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-?
The molecular weight of 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- is 168.08 g/mol.
Where can I buy 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)-?
You can request a quote for 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- 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, oxiranylmethyl ester, (E,E)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Hexadienoic acid, oxiranylmethyl ester, (E,E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.