Diallylaminoacetone
TL;DR: Diallylaminoacetone (CAS 73813-61-3) is a chemical compound with molecular formula C9H15NO and molecular weight 153.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(prop-2-enyl)amino]propan-2-one
Also Known As: Diallylaminoacetone, N,N-Diallylamino-propanon, 1-[bis(prop-2-enyl)amino]propan-2-one, 1-[Di(prop-2-en-1-yl)amino]propan-2-one, 1-[BIS(PROP-2-EN-1-YL)AMINO]PROPAN-2-ONE
| Molecular Formula | C9H15NO |
|---|---|
| Molecular Weight | 153.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 153.11537 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 73813-61-3 |
|---|---|
| SMILES | CC(=O)CN(CC=C)CC=C |
| InChIKey | NMQNNHLPNMVSQB-UHFFFAOYSA-N |
Product Overview
Diallylaminoacetone (CAS 73813-61-3), with molecular formula C9H15NO and molecular weight 153.12 g/mol. IUPAC: 1-[bis(prop-2-enyl)amino]propan-2-one.
Chemical Property Profile of Diallylaminoacetone
Property Insights of Diallylaminoacetone
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diallylaminoacetone. With a topological polar surface area (TPSA) of 20.3 Ų, Diallylaminoacetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diallylaminoacetone 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 Diallylaminoacetone?
The CAS number of Diallylaminoacetone is 73813-61-3.
What is the molecular formula of Diallylaminoacetone?
The molecular formula of Diallylaminoacetone is C9H15NO.
What is the molecular weight of Diallylaminoacetone?
The molecular weight of Diallylaminoacetone is 153.12 g/mol.
Where can I buy Diallylaminoacetone?
You can request a quote for Diallylaminoacetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diallylaminoacetone?
Yes, KEHONG BIO provides custom synthesis services for Diallylaminoacetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.