(NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d
TL;DR: (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d (CAS 6288-61-5) is a chemical compound with molecular formula C8H7Cl4NO and molecular weight 272.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-ylidene]hydroxylamine
Also Known As: (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d, N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-ylidene]hydroxylamine
| Molecular Formula | C8H7Cl4NO |
|---|---|
| Molecular Weight | 272.93 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 272.92816 |
| Heavy Atoms | 14 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 6288-61-5 |
|---|---|
| SMILES | CC1(C=CC(=NO)C(=C1)Cl)C(Cl)(Cl)Cl |
| InChIKey | UVFFWTNFFNXKJX-UHFFFAOYSA-N |
Product Overview
(NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d (CAS 6288-61-5), with molecular formula C8H7Cl4NO and molecular weight 272.93 g/mol. IUPAC: N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-ylidene]hydroxylamine.
Chemical Property Profile of (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d
Property Insights of (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d
The XLogP value of 4.4 indicates that (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.6 Ų, (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d 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 (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d?
The CAS number of (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d is 6288-61-5.
What is the molecular formula of (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d?
The molecular formula of (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d is C8H7Cl4NO.
What is the molecular weight of (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d?
The molecular weight of (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d is 272.93 g/mol.
Where can I buy (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d?
You can request a quote for (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d?
Yes, KEHONG BIO provides custom synthesis services for (NE)-N-[2-chloro-4-methyl-4-(trichloromethyl)cyclohexa-2,5-d and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.