(2-Nitrocyclohex-2-enyl)benzene
TL;DR: (2-Nitrocyclohex-2-enyl)benzene (CAS 84820-14-4) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-nitrocyclohex-2-en-1-yl)benzene
Also Known As: 1-Nitro-6-phenylcyclohexene, (2-Nitrocyclohex-2-enyl)benzene, (2-nitrocyclohex-2-en-1-yl)benzene, (2-Nitro-2-cyclohexen-1-yl)benzene #, J2.374.518F
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 84820-14-4 |
|---|---|
| SMILES | C1CC=C(C(C1)C2=CC=CC=C2)[N+](=O)[O-] |
| InChIKey | SZUIOINEHXCGBZ-UHFFFAOYSA-N |
Product Overview
(2-Nitrocyclohex-2-enyl)benzene (CAS 84820-14-4), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: (2-nitrocyclohex-2-en-1-yl)benzene.
Chemical Property Profile of (2-Nitrocyclohex-2-enyl)benzene
Property Insights of (2-Nitrocyclohex-2-enyl)benzene
The XLogP value of 3.3 indicates that (2-Nitrocyclohex-2-enyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, (2-Nitrocyclohex-2-enyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Nitrocyclohex-2-enyl)benzene has 0 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 (2-Nitrocyclohex-2-enyl)benzene?
The CAS number of (2-Nitrocyclohex-2-enyl)benzene is 84820-14-4.
What is the molecular formula of (2-Nitrocyclohex-2-enyl)benzene?
The molecular formula of (2-Nitrocyclohex-2-enyl)benzene is C12H13NO2.
What is the molecular weight of (2-Nitrocyclohex-2-enyl)benzene?
The molecular weight of (2-Nitrocyclohex-2-enyl)benzene is 203.09 g/mol.
Where can I buy (2-Nitrocyclohex-2-enyl)benzene?
You can request a quote for (2-Nitrocyclohex-2-enyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Nitrocyclohex-2-enyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (2-Nitrocyclohex-2-enyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.