(E)-1,3-Heptadiene, 4-methyl-
TL;DR: (E)-1,3-Heptadiene, 4-methyl- (CAS 40095-05-4) is a chemical compound with molecular formula C8H14 and molecular weight 110.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-4-methylhepta-1,3-diene
Also Known As: 6-Selenoinosin, 4-METHYL-1,3-HEPTADIENE, (3E)-4-methylhepta-1,3-diene, 4-Methyl-1,3-heptadiene (c,t), 4-methylhepta-1,3-diene
| Molecular Formula | C8H14 |
|---|---|
| Molecular Weight | 110.11 g/mol |
| LogP | 2.9188 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 110.10955 |
| Heavy Atoms | 8 |
| Complexity | 88.21143 |
Chemical Identifiers
| CAS Number | 40095-05-4 |
|---|---|
| SMILES | CCC/C(=C/C=C)/C |
Product Overview
(E)-1,3-Heptadiene, 4-methyl- (CAS 40095-05-4), with molecular formula C8H14 and molecular weight 110.11 g/mol. IUPAC: (3E)-4-methylhepta-1,3-diene.
Chemical Property Profile of (E)-1,3-Heptadiene, 4-methyl-
Property Insights of (E)-1,3-Heptadiene, 4-methyl-
The XLogP value of 2.9188 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1,3-Heptadiene, 4-methyl-. With a topological polar surface area (TPSA) of 0.0 Ų, (E)-1,3-Heptadiene, 4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-1,3-Heptadiene, 4-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)-1,3-Heptadiene, 4-methyl-?
The CAS number of (E)-1,3-Heptadiene, 4-methyl- is 40095-05-4.
What is the molecular formula of (E)-1,3-Heptadiene, 4-methyl-?
The molecular formula of (E)-1,3-Heptadiene, 4-methyl- is C8H14.
What is the molecular weight of (E)-1,3-Heptadiene, 4-methyl-?
The molecular weight of (E)-1,3-Heptadiene, 4-methyl- is 110.11 g/mol.
Where can I buy (E)-1,3-Heptadiene, 4-methyl-?
You can request a quote for (E)-1,3-Heptadiene, 4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1,3-Heptadiene, 4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for (E)-1,3-Heptadiene, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.