4-Amino-4-methyl-2-pentanone
TL;DR: 4-Amino-4-methyl-2-pentanone (CAS 625-04-7) is a chemical compound with molecular formula C6H13NO and molecular weight 115.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-4-methylpentan-2-one
Also Known As: Diacetonamine, 4-Amino-4-methyl-2-pentanone, 4-Amino-4-methylpentan-2-one, diacetoneamine, 2-Pentanone, 4-amino-4-methyl-
| Molecular Formula | C6H13NO |
|---|---|
| Molecular Weight | 115.10 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 115.09972 |
| Heavy Atoms | 8 |
| Complexity | 96.0 |
Chemical Identifiers
| CAS Number | 625-04-7 |
|---|---|
| SMILES | CC(=O)CC(C)(C)N |
| InChIKey | CQTRUFMMCCOKTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Amino-4-methyl-2-pentanone (CAS 625-04-7), with molecular formula C6H13NO and molecular weight 115.10 g/mol. IUPAC: 4-amino-4-methylpentan-2-one.
Chemical Property Profile of 4-Amino-4-methyl-2-pentanone
Property Insights of 4-Amino-4-methyl-2-pentanone
The XLogP value of -0.4 indicates that 4-Amino-4-methyl-2-pentanone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.1 Ų, 4-Amino-4-methyl-2-pentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Amino-4-methyl-2-pentanone has 1 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 4-Amino-4-methyl-2-pentanone?
The CAS number of 4-Amino-4-methyl-2-pentanone is 625-04-7.
What is the molecular formula of 4-Amino-4-methyl-2-pentanone?
The molecular formula of 4-Amino-4-methyl-2-pentanone is C6H13NO.
What is the molecular weight of 4-Amino-4-methyl-2-pentanone?
The molecular weight of 4-Amino-4-methyl-2-pentanone is 115.10 g/mol.
Where can I buy 4-Amino-4-methyl-2-pentanone?
You can request a quote for 4-Amino-4-methyl-2-pentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-4-methyl-2-pentanone?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-4-methyl-2-pentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.