2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-
TL;DR: 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- (CAS 14919-59-6) is a chemical compound with molecular formula C9H16O3 and molecular weight 172.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-5-hydroxy-3,4,4-trimethylhex-2-enoic acid
Also Known As: (E)-5-Hydroxy-3,4,4-trimethyl-2-hexenoic acid, 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-, (2E)-5-hydroxy-3,4,4-trimethylhex-2-enoic acid, (E)-5-hydroxy-3,4,4-trimethylhex-2-enoic acid, (2E)-5-Hydroxy-3,4,4-trimethyl-2-hexenoic acid
| Molecular Formula | C9H16O3 |
|---|---|
| Molecular Weight | 172.11 g/mol |
| LogP | 1.4243 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 172.10994 |
| Heavy Atoms | 12 |
| Complexity | 201.81918 |
Chemical Identifiers
| CAS Number | 14919-59-6 |
|---|---|
| SMILES | CC(C(C)(C)/C(=C/C(=O)O)/C)O |
Product Overview
2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- (CAS 14919-59-6), with molecular formula C9H16O3 and molecular weight 172.11 g/mol. IUPAC: (E)-5-hydroxy-3,4,4-trimethylhex-2-enoic acid.
Chemical Property Profile of 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-
Property Insights of 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-
The XLogP value of 1.4243 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-. With a topological polar surface area (TPSA) of 57.53 Ų, 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- has 2 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 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-?
The CAS number of 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- is 14919-59-6.
What is the molecular formula of 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-?
The molecular formula of 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- is C9H16O3.
What is the molecular weight of 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-?
The molecular weight of 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- is 172.11 g/mol.
Where can I buy 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-?
You can request a quote for 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Hexenoic acid, 5-hydroxy-3,4,4-trimethyl-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.