甲基丙二醛
TL;DR: 甲基丙二醛 (CAS 16002-19-0) is a chemical compound with molecular formula C4H6O2 and molecular weight 86.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基丙二醛
2-methylpropanedial
Also Known As: Methylmalondialdehyde, 2-methylpropanedial, methylmalonaldehyde, Propanedial, methyl-, methylpropanedial
| Molecular Formula | C4H6O2 |
|---|---|
| Molecular Weight | 86.04 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 86.03678 |
| Heavy Atoms | 6 |
| Complexity | 50.0 |
Chemical Identifiers
| CAS Number | 16002-19-0 |
|---|---|
| SMILES | CC(C=O)C=O |
| InChIKey | VXYSFSCCSQAYJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基丙二醛 (CAS 16002-19-0), with molecular formula C4H6O2 and molecular weight 86.04 g/mol. IUPAC: 2-methylpropanedial.
Chemical Property Profile of 甲基丙二醛
Property Insights of 甲基丙二醛
The XLogP value of -0.1 indicates that 甲基丙二醛 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.1 Ų, 甲基丙二醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基丙二醛 has 0 hydrogen bond donor(s) and 2 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 甲基丙二醛?
The CAS number of 甲基丙二醛 is 16002-19-0.
What is the molecular formula of 甲基丙二醛?
The molecular formula of 甲基丙二醛 is C4H6O2.
What is the molecular weight of 甲基丙二醛?
The molecular weight of 甲基丙二醛 is 86.04 g/mol.
Where can I buy 甲基丙二醛?
You can request a quote for 甲基丙二醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基丙二醛?
Yes, KEHONG BIO provides custom synthesis services for 甲基丙二醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.