1,2-Pentadiene, 4-methyl-
TL;DR: 1,2-Pentadiene, 4-methyl- (CAS 13643-05-5) 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-1,2-diene
Also Known As: 4-Methyl-1,2-pentadiene, 4-methylpenta-1,2-diene, 1,2-Pentadiene, 4-methyl-, CH2=C=CHCH(CH3)2, 4-Methyl-penta-1,2-dien
| Molecular Formula | C6H10 |
|---|---|
| Molecular Weight | 82.08 g/mol |
| LogP | 1.8 |
| 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 |
Chemical Identifiers
| CAS Number | 13643-05-5 |
|---|---|
| SMILES | CC(C)C=C=C |
| InChIKey | CAAAXQFHDYHTTC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Pentadiene, 4-methyl- (CAS 13643-05-5), with molecular formula C6H10 and molecular weight 82.08 g/mol. IUPAC: 4-methylpenta-1,2-diene.
Chemical Property Profile of 1,2-Pentadiene, 4-methyl-
Property Insights of 1,2-Pentadiene, 4-methyl-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Pentadiene, 4-methyl-. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Pentadiene, 4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Pentadiene, 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 1,2-Pentadiene, 4-methyl-?
The CAS number of 1,2-Pentadiene, 4-methyl- is 13643-05-5.
What is the molecular formula of 1,2-Pentadiene, 4-methyl-?
The molecular formula of 1,2-Pentadiene, 4-methyl- is C6H10.
What is the molecular weight of 1,2-Pentadiene, 4-methyl-?
The molecular weight of 1,2-Pentadiene, 4-methyl- is 82.08 g/mol.
Where can I buy 1,2-Pentadiene, 4-methyl-?
You can request a quote for 1,2-Pentadiene, 4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Pentadiene, 4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Pentadiene, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.