N-(butan-2-ylideneamino)-3-nitroaniline
TL;DR: N-(butan-2-ylideneamino)-3-nitroaniline (CAS 18492-23-4) is a chemical compound with molecular formula C10H13N3O2 and molecular weight 207.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(butan-2-ylideneamino)-3-nitroaniline
Also Known As: butan-2-one-(3-nitro-phenylhydrazone), N-(butan-2-ylideneamino)-3-nitroaniline
| Molecular Formula | C10H13N3O2 |
|---|---|
| Molecular Weight | 207.10 g/mol |
| LogP | 2.7926 |
| Topological Polar Surface Area | 67.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.10077 |
| Heavy Atoms | 15 |
| Complexity | 388.00882 |
Chemical Identifiers
| CAS Number | 18492-23-4 |
|---|---|
| SMILES | CCC(=NNC1=CC(=CC=C1)[N+](=O)[O-])C |
Product Overview
N-(butan-2-ylideneamino)-3-nitroaniline (CAS 18492-23-4), with molecular formula C10H13N3O2 and molecular weight 207.10 g/mol. IUPAC: N-(butan-2-ylideneamino)-3-nitroaniline.
Chemical Property Profile of N-(butan-2-ylideneamino)-3-nitroaniline
Property Insights of N-(butan-2-ylideneamino)-3-nitroaniline
The XLogP value of 2.7926 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(butan-2-ylideneamino)-3-nitroaniline. The TPSA of 67.53 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(butan-2-ylideneamino)-3-nitroaniline. Following Lipinski's Rule of Five, N-(butan-2-ylideneamino)-3-nitroaniline 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 N-(butan-2-ylideneamino)-3-nitroaniline?
The CAS number of N-(butan-2-ylideneamino)-3-nitroaniline is 18492-23-4.
What is the molecular formula of N-(butan-2-ylideneamino)-3-nitroaniline?
The molecular formula of N-(butan-2-ylideneamino)-3-nitroaniline is C10H13N3O2.
What is the molecular weight of N-(butan-2-ylideneamino)-3-nitroaniline?
The molecular weight of N-(butan-2-ylideneamino)-3-nitroaniline is 207.10 g/mol.
Where can I buy N-(butan-2-ylideneamino)-3-nitroaniline?
You can request a quote for N-(butan-2-ylideneamino)-3-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(butan-2-ylideneamino)-3-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(butan-2-ylideneamino)-3-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.