1,3-Hexadiene, 3-ethyl-2,5-dimethyl-
TL;DR: 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- (CAS 62338-07-2) is a chemical compound with molecular formula C10H18 and molecular weight 138.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2,5-dimethylhexa-1,3-diene
Also Known As: 1,3-Hexadiene, 3-ethyl-2,5-dimethyl-, 3-ethyl-2,5-dimethylhexa-1,3-diene, 3-ethyl-2,5-dimethyl-1,3-hexadiene, 2,5-Dimethyl-3-ethyl-1,3-hexadiene, RefChem:219225
| Molecular Formula | C10H18 |
|---|---|
| Molecular Weight | 138.14 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 138.14085 |
| Heavy Atoms | 10 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 62338-07-2 |
|---|---|
| SMILES | CCC(=CC(C)C)C(=C)C |
| InChIKey | RDFFKERPGUXBGR-UHFFFAOYSA-N |
Product Overview
1,3-Hexadiene, 3-ethyl-2,5-dimethyl- (CAS 62338-07-2), with molecular formula C10H18 and molecular weight 138.14 g/mol. IUPAC: 3-ethyl-2,5-dimethylhexa-1,3-diene.
Chemical Property Profile of 1,3-Hexadiene, 3-ethyl-2,5-dimethyl-
Property Insights of 1,3-Hexadiene, 3-ethyl-2,5-dimethyl-
The XLogP value of 4.5 indicates that 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- 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 1,3-Hexadiene, 3-ethyl-2,5-dimethyl-?
The CAS number of 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- is 62338-07-2.
What is the molecular formula of 1,3-Hexadiene, 3-ethyl-2,5-dimethyl-?
The molecular formula of 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- is C10H18.
What is the molecular weight of 1,3-Hexadiene, 3-ethyl-2,5-dimethyl-?
The molecular weight of 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- is 138.14 g/mol.
Where can I buy 1,3-Hexadiene, 3-ethyl-2,5-dimethyl-?
You can request a quote for 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Hexadiene, 3-ethyl-2,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Hexadiene, 3-ethyl-2,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.