(E,E)-1,3,5-Heptatriene, 5-methyl-
TL;DR: (E,E)-1,3,5-Heptatriene, 5-methyl- (CAS 58434-77-8) is a chemical compound with molecular formula C8H12 and molecular weight 108.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E,5E)-5-methylhepta-1,3,5-triene
Also Known As: 3-methyl-2,4,6-heptatriene, (E,E)-1,3,5-Heptatriene, 5-methyl-, (3E,5E)-5-methylhepta-1,3,5-triene, (E),(E)-CH3CH=C(CH3)CH=CHCH=CH2, 1,3,5-Heptatriene, 5-methyl-, (E,E)-
| Molecular Formula | C8H12 |
|---|---|
| Molecular Weight | 108.09 g/mol |
| LogP | 2.6948 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 108.0939 |
| Heavy Atoms | 8 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 58434-77-8 |
|---|---|
| SMILES | C/C=C(\C)/C=C/C=C |
Product Overview
(E,E)-1,3,5-Heptatriene, 5-methyl- (CAS 58434-77-8), with molecular formula C8H12 and molecular weight 108.09 g/mol. IUPAC: (3E,5E)-5-methylhepta-1,3,5-triene.
Chemical Property Profile of (E,E)-1,3,5-Heptatriene, 5-methyl-
Property Insights of (E,E)-1,3,5-Heptatriene, 5-methyl-
The XLogP value of 2.6948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E,E)-1,3,5-Heptatriene, 5-methyl-. With a topological polar surface area (TPSA) of 0.0 Ų, (E,E)-1,3,5-Heptatriene, 5-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E,E)-1,3,5-Heptatriene, 5-methyl- has 0 hydrogen bond donor(s) and 0 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 (E,E)-1,3,5-Heptatriene, 5-methyl-?
The CAS number of (E,E)-1,3,5-Heptatriene, 5-methyl- is 58434-77-8.
What is the molecular formula of (E,E)-1,3,5-Heptatriene, 5-methyl-?
The molecular formula of (E,E)-1,3,5-Heptatriene, 5-methyl- is C8H12.
What is the molecular weight of (E,E)-1,3,5-Heptatriene, 5-methyl-?
The molecular weight of (E,E)-1,3,5-Heptatriene, 5-methyl- is 108.09 g/mol.
Where can I buy (E,E)-1,3,5-Heptatriene, 5-methyl-?
You can request a quote for (E,E)-1,3,5-Heptatriene, 5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E,E)-1,3,5-Heptatriene, 5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for (E,E)-1,3,5-Heptatriene, 5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.