3-金刚烷基羟甲基酮肟
TL;DR: 3-金刚烷基羟甲基酮肟 (CAS 65788-01-4) is a chemical compound with molecular formula C12H19NO2 and molecular weight 209.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-金刚烷基羟甲基酮肟
2-(1-adamantyl)-2-hydroxyiminoethanol
Also Known As: 3-Adamantyl hydroxymethyl ketone oxime, 2-(1-adamantyl)-2-hydroxyiminoethanol, Ethanone, 2-hydroxy-1-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-, oxime
| Molecular Formula | C12H19NO2 |
|---|---|
| Molecular Weight | 209.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 52.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.14159 |
| Heavy Atoms | 15 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 65788-01-4 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=NO)CO |
| InChIKey | ISNBMIJYDKQPQY-UHFFFAOYSA-N |
Product Overview
3-金刚烷基羟甲基酮肟 (CAS 65788-01-4), with molecular formula C12H19NO2 and molecular weight 209.14 g/mol. IUPAC: 2-(1-adamantyl)-2-hydroxyiminoethanol.
Chemical Property Profile of 3-金刚烷基羟甲基酮肟
Property Insights of 3-金刚烷基羟甲基酮肟
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-金刚烷基羟甲基酮肟. With a topological polar surface area (TPSA) of 52.8 Ų, 3-金刚烷基羟甲基酮肟 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-金刚烷基羟甲基酮肟 has 2 hydrogen bond donor(s) and 3 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 3-金刚烷基羟甲基酮肟?
The CAS number of 3-金刚烷基羟甲基酮肟 is 65788-01-4.
What is the molecular formula of 3-金刚烷基羟甲基酮肟?
The molecular formula of 3-金刚烷基羟甲基酮肟 is C12H19NO2.
What is the molecular weight of 3-金刚烷基羟甲基酮肟?
The molecular weight of 3-金刚烷基羟甲基酮肟 is 209.14 g/mol.
Where can I buy 3-金刚烷基羟甲基酮肟?
You can request a quote for 3-金刚烷基羟甲基酮肟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-金刚烷基羟甲基酮肟?
Yes, KEHONG BIO provides custom synthesis services for 3-金刚烷基羟甲基酮肟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.