2-甲基-2-戊烯醛
TL;DR: 2-甲基-2-戊烯醛 (CAS 623-36-9) is a chemical compound with molecular formula C6H10O and molecular weight 98.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-甲基-2-戊烯醛
2-methylpent-2-enal
Also Known As: 2-Methylpent-2-enal, 2-METHYL-2-PENTENAL, 2-Pentenal, 2-methyl-, 2-methyl-pent-2-enal, 2-methyl 2-pentenal
| Molecular Formula | C6H10O |
|---|---|
| Molecular Weight | 98.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 98.073166 |
| Heavy Atoms | 7 |
| Complexity | 82.0 |
| Density | 0.855-0.865 |
| Solubility | Insoluble in water; soluble in ether, benzene, methanol |
| Refractive Index | 1.445-1.453 |
Chemical Identifiers
| CAS Number | 623-36-9 |
|---|---|
| SMILES | CCC=C(C)C=O |
| InChIKey | IDEYZABHVQLHAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-甲基-2-戊烯醛 (CAS 623-36-9), with molecular formula C6H10O and molecular weight 98.07 g/mol. IUPAC: 2-methylpent-2-enal.
Chemical Property Profile of 2-甲基-2-戊烯醛
Property Insights of 2-甲基-2-戊烯醛
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-甲基-2-戊烯醛. With a topological polar surface area (TPSA) of 17.1 Ų, 2-甲基-2-戊烯醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-甲基-2-戊烯醛 has 0 hydrogen bond donor(s) and 1 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 2-甲基-2-戊烯醛?
The CAS number of 2-甲基-2-戊烯醛 is 623-36-9.
What is the molecular formula of 2-甲基-2-戊烯醛?
The molecular formula of 2-甲基-2-戊烯醛 is C6H10O.
What is the molecular weight of 2-甲基-2-戊烯醛?
The molecular weight of 2-甲基-2-戊烯醛 is 98.07 g/mol.
Where can I buy 2-甲基-2-戊烯醛?
You can request a quote for 2-甲基-2-戊烯醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-甲基-2-戊烯醛?
Yes, KEHONG BIO provides custom synthesis services for 2-甲基-2-戊烯醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.