trans-3-Heptene
TL;DR: trans-3-Heptene (CAS 68476-39-1) is a chemical compound with molecular formula C7H14 and molecular weight 98.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-hept-3-ene
Also Known As: trans-3-Heptene, (E)-Hept-3-ene, (E)-3-Heptene, 3-Heptene, (3E)-, Hept-3-ene
| Molecular Formula | C7H14 |
|---|---|
| Molecular Weight | 98.11 g/mol |
| LogP | 2.7527 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 98.10955 |
| Heavy Atoms | 7 |
| Complexity | 44.0 |
Chemical Identifiers
| CAS Number | 68476-39-1 |
|---|---|
| SMILES | CCC/C=C/CC |
Product Overview
trans-3-Heptene (CAS 68476-39-1), with molecular formula C7H14 and molecular weight 98.11 g/mol. IUPAC: (E)-hept-3-ene.
Chemical Property Profile of trans-3-Heptene
Property Insights of trans-3-Heptene
The XLogP value of 2.7527 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-3-Heptene. With a topological polar surface area (TPSA) of 0.0 Ų, trans-3-Heptene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-3-Heptene 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 trans-3-Heptene?
The CAS number of trans-3-Heptene is 68476-39-1.
What is the molecular formula of trans-3-Heptene?
The molecular formula of trans-3-Heptene is C7H14.
What is the molecular weight of trans-3-Heptene?
The molecular weight of trans-3-Heptene is 98.11 g/mol.
Where can I buy trans-3-Heptene?
You can request a quote for trans-3-Heptene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-3-Heptene?
Yes, KEHONG BIO provides custom synthesis services for trans-3-Heptene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.