2-Pentanone, 5-(diethylamino)-
TL;DR: 2-Pentanone, 5-(diethylamino)- (CAS 105-14-6) is a chemical compound with molecular formula C9H19NO and molecular weight 157.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(diethylamino)pentan-2-one
Also Known As: 5-Diethylamino-2-pentanone, 5-(diethylamino)pentan-2-one, Novol ketone, Novalketone, Anise alcohol
| Molecular Formula | C9H19NO |
|---|---|
| Molecular Weight | 157.15 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 157.14667 |
| Heavy Atoms | 11 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 105-14-6 |
|---|---|
| SMILES | CCN(CC)CCCC(=O)C |
| InChIKey | GRGNJBKJCVOFEO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Pentanone, 5-(diethylamino)- (CAS 105-14-6), with molecular formula C9H19NO and molecular weight 157.15 g/mol. IUPAC: 5-(diethylamino)pentan-2-one.
Chemical Property Profile of 2-Pentanone, 5-(diethylamino)-
Property Insights of 2-Pentanone, 5-(diethylamino)-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pentanone, 5-(diethylamino)-. With a topological polar surface area (TPSA) of 20.3 Ų, 2-Pentanone, 5-(diethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pentanone, 5-(diethylamino)- 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 2-Pentanone, 5-(diethylamino)-?
The CAS number of 2-Pentanone, 5-(diethylamino)- is 105-14-6.
What is the molecular formula of 2-Pentanone, 5-(diethylamino)-?
The molecular formula of 2-Pentanone, 5-(diethylamino)- is C9H19NO.
What is the molecular weight of 2-Pentanone, 5-(diethylamino)-?
The molecular weight of 2-Pentanone, 5-(diethylamino)- is 157.15 g/mol.
Where can I buy 2-Pentanone, 5-(diethylamino)-?
You can request a quote for 2-Pentanone, 5-(diethylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pentanone, 5-(diethylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentanone, 5-(diethylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.