Benzenamine, N-(1-methylethyl)-4-nitro-
TL;DR: Benzenamine, N-(1-methylethyl)-4-nitro- (CAS 25186-43-0) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-nitro-N-propan-2-ylaniline
Also Known As: N-Isopropyl-4-nitroaniline, 4-nitro-N-propan-2-ylaniline, Benzenamine, N-(1-methylethyl)-4-nitro-, N-isopropyl-4-nitro-aniline, 4-isopropylamino-nitrobenzene
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H12N2O2 |
| Molecular Weight | 180.08987 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.08987 Da |
| Heavy Atoms | 13 |
| Complexity | 169.0 |
| SMILES | CC(C)NC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | VTSUWHFLMJLYKN-UHFFFAOYSA-N |
Chemical Property Profile of Benzenamine, N-(1-methylethyl)-4-nitro-
Property Insights of Benzenamine, N-(1-methylethyl)-4-nitro-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, N-(1-methylethyl)-4-nitro-. With a topological polar surface area (TPSA) of 57.9 Ų, Benzenamine, N-(1-methylethyl)-4-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, N-(1-methylethyl)-4-nitro- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzenamine, N-(1-methylethyl)-4-nitro-?
The CAS number of Benzenamine, N-(1-methylethyl)-4-nitro- is 25186-43-0.
What is the molecular formula of Benzenamine, N-(1-methylethyl)-4-nitro-?
The molecular formula of Benzenamine, N-(1-methylethyl)-4-nitro- is C9H12N2O2.
What is the molecular weight of Benzenamine, N-(1-methylethyl)-4-nitro-?
The molecular weight of Benzenamine, N-(1-methylethyl)-4-nitro- is 180.08987 g/mol.
Where can I buy Benzenamine, N-(1-methylethyl)-4-nitro-?
You can request a quote for Benzenamine, N-(1-methylethyl)-4-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzenamine, N-(1-methylethyl)-4-nitro-?
Yes, CoreyChem provides custom synthesis services for Benzenamine, N-(1-methylethyl)-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.