1-Adamantan-1-YL-propan-1-one oxime
TL;DR: 1-Adamantan-1-YL-propan-1-one oxime (CAS 78679-72-8) is a chemical compound with molecular formula C13H21NO and molecular weight 207.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NE)-N-[1-(1-adamantyl)propylidene]hydroxylamine
Also Known As: (1E)-1-(1-adamantyl)propan-1-one oxime, N-[1-(adamantan-1-yl)propylidene]hydroxylamine, 1-ADAMANTAN-1-YL-PROPAN-1-ONE OXIME, (NE)-N-[1-(1-adamantyl)propylidene]hydroxylamine, N-[(1E)-1-(Adamantan-1-yl)propylidene]hydroxylamine
| Molecular Formula | C13H21NO |
|---|---|
| Molecular Weight | 207.16 g/mol |
| LogP | 3.443 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.16231 |
| Heavy Atoms | 15 |
| Complexity | 259.62686 |
Chemical Identifiers
| CAS Number | 78679-72-8 |
|---|---|
| SMILES | CC/C(=N\O)/C12CC3CC(C1)CC(C3)C2 |
Product Overview
1-Adamantan-1-YL-propan-1-one oxime (CAS 78679-72-8), with molecular formula C13H21NO and molecular weight 207.16 g/mol. IUPAC: (NE)-N-[1-(1-adamantyl)propylidene]hydroxylamine.
Chemical Property Profile of 1-Adamantan-1-YL-propan-1-one oxime
Property Insights of 1-Adamantan-1-YL-propan-1-one oxime
The XLogP value of 3.443 indicates that 1-Adamantan-1-YL-propan-1-one oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.59 Ų, 1-Adamantan-1-YL-propan-1-one oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Adamantan-1-YL-propan-1-one oxime 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 1-Adamantan-1-YL-propan-1-one oxime?
The CAS number of 1-Adamantan-1-YL-propan-1-one oxime is 78679-72-8.
What is the molecular formula of 1-Adamantan-1-YL-propan-1-one oxime?
The molecular formula of 1-Adamantan-1-YL-propan-1-one oxime is C13H21NO.
What is the molecular weight of 1-Adamantan-1-YL-propan-1-one oxime?
The molecular weight of 1-Adamantan-1-YL-propan-1-one oxime is 207.16 g/mol.
Where can I buy 1-Adamantan-1-YL-propan-1-one oxime?
You can request a quote for 1-Adamantan-1-YL-propan-1-one oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Adamantan-1-YL-propan-1-one oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-Adamantan-1-YL-propan-1-one oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.