3-Methyl-1,2-pentadiene
TL;DR: 3-Methyl-1,2-pentadiene (CAS 7417-48-3) 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.
3-methylpenta-1,2-diene
Also Known As: 3-Methylpenta-1,2-diene, 1,2-Pentadiene,3-methyl-, 3-METHYL-1,2-PENTADIENE, 1,2-Pentadiene, 3-methyl-, CH2=C=C(CH3)C2H5
| Molecular Formula | C6H10 |
|---|---|
| Molecular Weight | 82.08 g/mol |
| LogP | 2.1 |
| 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 | 74.0 |
Chemical Identifiers
| CAS Number | 7417-48-3 |
|---|---|
| SMILES | CCC(=C=C)C |
| InChIKey | INFFCVIZNSUFGK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methyl-1,2-pentadiene (CAS 7417-48-3), with molecular formula C6H10 and molecular weight 82.08 g/mol. IUPAC: 3-methylpenta-1,2-diene.
Chemical Property Profile of 3-Methyl-1,2-pentadiene
Property Insights of 3-Methyl-1,2-pentadiene
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1,2-pentadiene. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Methyl-1,2-pentadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1,2-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 3-Methyl-1,2-pentadiene?
The CAS number of 3-Methyl-1,2-pentadiene is 7417-48-3.
What is the molecular formula of 3-Methyl-1,2-pentadiene?
The molecular formula of 3-Methyl-1,2-pentadiene is C6H10.
What is the molecular weight of 3-Methyl-1,2-pentadiene?
The molecular weight of 3-Methyl-1,2-pentadiene is 82.08 g/mol.
Where can I buy 3-Methyl-1,2-pentadiene?
You can request a quote for 3-Methyl-1,2-pentadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1,2-pentadiene?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1,2-pentadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.