4-氯-N-乙基-N-甲基苯胺N-氧化物
TL;DR: 4-氯-N-乙基-N-甲基苯胺N-氧化物 (CAS 67274-60-6) is a chemical compound with molecular formula C9H12ClNO and molecular weight 185.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氯-N-乙基-N-甲基苯胺N-氧化物
4-chloro-N-ethyl-N-methylbenzeneamine oxide
Also Known As: Benzenamine, 4-chloro-N-ethyl-N-methyl-, N-oxide, 4-chloro-N-ethyl-N-methylbenzeneamine oxide, Benzenamine,4-chloro-N-ethyl-N-methyl-,N-oxide, 4-Chloro-N-ethyl-N-methylbenzen-1-amine N-oxide
| Molecular Formula | C9H12ClNO |
|---|---|
| Molecular Weight | 185.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.06075 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 67274-60-6 |
|---|---|
| SMILES | CC[N+](C)(C1=CC=C(C=C1)Cl)[O-] |
| InChIKey | LHVYTXUWFMSIPE-UHFFFAOYSA-N |
Product Overview
4-氯-N-乙基-N-甲基苯胺N-氧化物 (CAS 67274-60-6), with molecular formula C9H12ClNO and molecular weight 185.06 g/mol. IUPAC: 4-chloro-N-ethyl-N-methylbenzeneamine oxide.
Chemical Property Profile of 4-氯-N-乙基-N-甲基苯胺N-氧化物
Property Insights of 4-氯-N-乙基-N-甲基苯胺N-氧化物
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氯-N-乙基-N-甲基苯胺N-氧化物. With a topological polar surface area (TPSA) of 18.1 Ų, 4-氯-N-乙基-N-甲基苯胺N-氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氯-N-乙基-N-甲基苯胺N-氧化物 has 0 hydrogen bond donor(s) and 1 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 4-氯-N-乙基-N-甲基苯胺N-氧化物?
The CAS number of 4-氯-N-乙基-N-甲基苯胺N-氧化物 is 67274-60-6.
What is the molecular formula of 4-氯-N-乙基-N-甲基苯胺N-氧化物?
The molecular formula of 4-氯-N-乙基-N-甲基苯胺N-氧化物 is C9H12ClNO.
What is the molecular weight of 4-氯-N-乙基-N-甲基苯胺N-氧化物?
The molecular weight of 4-氯-N-乙基-N-甲基苯胺N-氧化物 is 185.06 g/mol.
Where can I buy 4-氯-N-乙基-N-甲基苯胺N-氧化物?
You can request a quote for 4-氯-N-乙基-N-甲基苯胺N-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氯-N-乙基-N-甲基苯胺N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 4-氯-N-乙基-N-甲基苯胺N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.