1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime
TL;DR: 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime (CAS 6155-58-4) is a chemical compound with molecular formula C10H15NO and molecular weight 165.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)methylidene]hydroxylamine
Also Known As: 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime, 2,6,6-Trimethyl-1,3-cyclohexadiene-1-carbaldehydeoxime, (NE)-N-[(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)methylidene]hydroxylamine, RefChem:414165
| Molecular Formula | C10H15NO |
|---|---|
| Molecular Weight | 165.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 165.11537 |
| Heavy Atoms | 12 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 6155-58-4 |
|---|---|
| SMILES | CC1=C(C(CC=C1)(C)C)C=NO |
| InChIKey | POYDEASPSJCUBW-UHFFFAOYSA-N |
Product Overview
1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime (CAS 6155-58-4), with molecular formula C10H15NO and molecular weight 165.12 g/mol. IUPAC: N-[(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)methylidene]hydroxylamine.
Chemical Property Profile of 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime
Property Insights of 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime. With a topological polar surface area (TPSA) of 32.6 Ų, 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, 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 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime?
The CAS number of 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime is 6155-58-4.
What is the molecular formula of 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime?
The molecular formula of 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime is C10H15NO.
What is the molecular weight of 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime?
The molecular weight of 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime is 165.12 g/mol.
Where can I buy 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime?
You can request a quote for 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.