(1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether
TL;DR: (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether (CAS 85002-76-2) is a chemical compound with molecular formula C14H19NO3 and molecular weight 249.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1-methylcyclohexyl)methoxy]-4-nitrobenzene
Also Known As: (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether, 1-[(1-methylcyclohexyl)methoxy]-4-nitrobenzene, 1-Methyl-1-cyclohexanemethyl-4-nitrophenyl, 1-((1-Methylcyclohexyl)methoxy)-4-nitrobenzene, 1-[(1-methylcyclohexyl)methoxy]-4-nitro-benzene
| Molecular Formula | C14H19NO3 |
|---|---|
| Molecular Weight | 249.14 g/mol |
| LogP | 3.944 |
| Topological Polar Surface Area | 52.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.13649 |
| Heavy Atoms | 18 |
| Complexity | 407.55222 |
Chemical Identifiers
| CAS Number | 85002-76-2 |
|---|---|
| SMILES | CC1(CCCCC1)COC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
(1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether (CAS 85002-76-2), with molecular formula C14H19NO3 and molecular weight 249.14 g/mol. IUPAC: 1-[(1-methylcyclohexyl)methoxy]-4-nitrobenzene.
Chemical Property Profile of (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether
Property Insights of (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether
The XLogP value of 3.944 indicates that (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.37 Ų, (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether has 0 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 (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether?
The CAS number of (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether is 85002-76-2.
What is the molecular formula of (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether?
The molecular formula of (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether is C14H19NO3.
What is the molecular weight of (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether?
The molecular weight of (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether is 249.14 g/mol.
Where can I buy (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether?
You can request a quote for (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether?
Yes, KEHONG BIO provides custom synthesis services for (1-Methylcyclohexanyl)methyl-4-nitrophenyl Ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.