trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid
TL;DR: trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid (CAS 65860-56-2) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2,6-dimethyl-5-methylidenehept-2-enoic acid
Also Known As: trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid, (E)-2,6-dimethyl-5-methylidenehept-2-enoic acid, 2,6-dimethyl-5-methylenehept-2-enoic acid, 2-methyl-5-isopropylhexa-2,5-dienoic acid, trans-2,6-dimethyl-5-methylenehept-2-enoic acid
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 2.6196 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 211.87846 |
Chemical Identifiers
| CAS Number | 65860-56-2 |
|---|---|
| SMILES | CC(C)C(=C)C/C=C(\C)/C(=O)O |
Product Overview
trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid (CAS 65860-56-2), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: (E)-2,6-dimethyl-5-methylidenehept-2-enoic acid.
Chemical Property Profile of trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid
Property Insights of trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid
The XLogP value of 2.6196 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid 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 trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid?
The CAS number of trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid is 65860-56-2.
What is the molecular formula of trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid?
The molecular formula of trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid is C10H16O2.
What is the molecular weight of trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid?
The molecular weight of trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid is 168.12 g/mol.
Where can I buy trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid?
You can request a quote for trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid?
Yes, KEHONG BIO provides custom synthesis services for trans-2-Methyl-5-isopropylhexa-2,5-dienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.