![Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- structure](/static/products/2963/2963-44-2.webp)
Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-
TL;DR: Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- (CAS 2963-44-2) is a chemical compound with molecular formula C9H8ClN3O2 and molecular weight 225.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-2-nitroanilino)propanenitrile
Also Known As: 3-(4-chloro-2-nitroanilino)propanenitrile, Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-, 3-[(4-CHLORO-2-NITROPHENYL)AMINO]PROPANENITRILE
| Molecular Formula | C9H8ClN3O2 |
|---|---|
| Molecular Weight | 225.03 g/mol |
| LogP | 2.57378 |
| Topological Polar Surface Area | 78.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.0305 |
| Heavy Atoms | 15 |
| Complexity | 414.30875 |
Chemical Identifiers
| CAS Number | 2963-44-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)[N+](=O)[O-])NCCC#N |
Product Overview
Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- (CAS 2963-44-2), with molecular formula C9H8ClN3O2 and molecular weight 225.03 g/mol. IUPAC: 3-(4-chloro-2-nitroanilino)propanenitrile.
Chemical Property Profile of Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-
Property Insights of Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-
The XLogP value of 2.57378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-. The TPSA of 78.96 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-. Following Lipinski's Rule of Five, Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- has 1 hydrogen bond donor(s) and 4 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 Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-?
The CAS number of Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- is 2963-44-2.
What is the molecular formula of Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-?
The molecular formula of Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- is C9H8ClN3O2.
What is the molecular weight of Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-?
The molecular weight of Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- is 225.03 g/mol.
Where can I buy Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-?
You can request a quote for Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 3-[(4-chloro-2-nitrophenyl)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.