amine structure](/static/products/893/893590-94-8.png)
[(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine
TL;DR: [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine (CAS 893590-94-8) is a chemical compound with molecular formula C10H12N2O2 and molecular weight 192.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-nitrophenyl)methyl]prop-2-en-1-amine
Also Known As: [(3-NITROPHENYL)METHYL](PROP-2-EN-1-YL)AMINE|N-[(3-nitrophenyl)methyl]prop-2-en-1-amine|(3-nitrophenyl)methyl(prop-2-en-1-yl)amine|Benzenemethanamine, 3-nitro-N-2-propen-1-yl|N-(3-NITROBENZYL)PROP-2-EN-1-AMINE|((3-nitrophenyl)methyl)(prop-2-en-1-yl)amine|Benzenemethanamine, 3-nitro-N-2-propen-1-yl-|967-255-6|RefChem:390045|EN300-144979
| Molecular Formula | C10H12N2O2 |
|---|---|
| Molecular Weight | 192.09 g/mol |
| LogP | 1.8704 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.08987 |
| Heavy Atoms | 14 |
| Complexity | 336.6488 |
Chemical Identifiers
| CAS Number | 893590-94-8 |
|---|---|
| SMILES | C=CCNCC1=CC(=CC=C1)[N+](=O)[O-] |
Product Overview
[(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine (CAS 893590-94-8), with molecular formula C10H12N2O2 and molecular weight 192.09 g/mol. IUPAC: N-[(3-nitrophenyl)methyl]prop-2-en-1-amine.
Chemical Property Profile of [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine
Property Insights of [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine
The XLogP value of 1.8704 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine. With a topological polar surface area (TPSA) of 55.17 Ų, [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine 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 [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine?
The CAS number of [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine is 893590-94-8.
What is the molecular formula of [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine?
The molecular formula of [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine is C10H12N2O2.
What is the molecular weight of [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine?
The molecular weight of [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine is 192.09 g/mol.
Where can I buy [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine?
You can request a quote for [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine?
Yes, KEHONG BIO provides custom synthesis services for [(3-Nitrophenyl)methyl](prop-2-en-1-yl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.