N-Nitrobenzenemethanamine
TL;DR: N-Nitrobenzenemethanamine (CAS 19091-99-7) is a chemical compound with molecular formula C7H8N2O2 and molecular weight 152.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzylnitramide
Also Known As: N-benzylnitramide, N-Nitrobenzenemethanamine, nitrobenzylamine, benzyl-nitro-amine, N-Nitro-benzylamine
| Molecular Formula | C7H8N2O2 |
|---|---|
| Molecular Weight | 152.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.05858 |
| Heavy Atoms | 11 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 19091-99-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN[N+](=O)[O-] |
| InChIKey | FJCCWUVWFDOSAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Nitrobenzenemethanamine (CAS 19091-99-7), with molecular formula C7H8N2O2 and molecular weight 152.06 g/mol. IUPAC: N-benzylnitramide.
Chemical Property Profile of N-Nitrobenzenemethanamine
Property Insights of N-Nitrobenzenemethanamine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nitrobenzenemethanamine. With a topological polar surface area (TPSA) of 57.9 Ų, N-Nitrobenzenemethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Nitrobenzenemethanamine 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
Frequently Asked Questions
What is the CAS number of N-Nitrobenzenemethanamine?
The CAS number of N-Nitrobenzenemethanamine is 19091-99-7.
What is the molecular formula of N-Nitrobenzenemethanamine?
The molecular formula of N-Nitrobenzenemethanamine is C7H8N2O2.
What is the molecular weight of N-Nitrobenzenemethanamine?
The molecular weight of N-Nitrobenzenemethanamine is 152.06 g/mol.
Where can I buy N-Nitrobenzenemethanamine?
You can request a quote for N-Nitrobenzenemethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nitrobenzenemethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-Nitrobenzenemethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.