4-Methyl-1,3-pentadiene
TL;DR: 4-Methyl-1,3-pentadiene (CAS 926-56-7) is a chemical compound with molecular formula C6H10 and molecular weight 82.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylpenta-1,3-diene
Also Known As: 4-Methylpenta-1,3-diene, 4-METHYL-1,3-PENTADIENE, Methylpentadiene, dimethylbutadiene, 1,3-Pentadiene, 4-methyl-
| Molecular Formula | C6H10 |
|---|---|
| Molecular Weight | 82.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 82.07825 |
| Heavy Atoms | 6 |
| Complexity | 64.0 |
| Flash Point | -34.4 °C (NFPA, 2010) |
Chemical Identifiers
| CAS Number | 926-56-7 |
|---|---|
| SMILES | CC(=CC=C)C |
| InChIKey | CJSBUWDGPXGFGA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-1,3-pentadiene (CAS 926-56-7), with molecular formula C6H10 and molecular weight 82.08 g/mol. IUPAC: 4-methylpenta-1,3-diene.
Chemical Property Profile of 4-Methyl-1,3-pentadiene
Property Insights of 4-Methyl-1,3-pentadiene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-1,3-pentadiene. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Methyl-1,3-pentadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-1,3-pentadiene 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 4-Methyl-1,3-pentadiene?
The CAS number of 4-Methyl-1,3-pentadiene is 926-56-7.
What is the molecular formula of 4-Methyl-1,3-pentadiene?
The molecular formula of 4-Methyl-1,3-pentadiene is C6H10.
What is the molecular weight of 4-Methyl-1,3-pentadiene?
The molecular weight of 4-Methyl-1,3-pentadiene is 82.08 g/mol.
Where can I buy 4-Methyl-1,3-pentadiene?
You can request a quote for 4-Methyl-1,3-pentadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-1,3-pentadiene?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-1,3-pentadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.