Benzen-2,3,5,6-d4-amine-d2, 4-nitro-
TL;DR: Benzen-2,3,5,6-d4-amine-d2, 4-nitro- (CAS 68239-24-7) is a chemical compound with molecular formula C6H6N2O2 and molecular weight 144.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N,2,3,5,6-hexadeuterio-4-nitroaniline
Also Known As: p-Nitroaniline, 4-nitro[2H6]aniline, 4-Nitro(2H6)aniline, 4-Nitro(~2~H_6_)aniline, Benzen-2,3,5,6-d4-amine-d2, 4-nitro-
| Molecular Formula | C6H6N2O2 |
|---|---|
| Molecular Weight | 144.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.08058 |
| Heavy Atoms | 10 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 68239-24-7 |
|---|---|
| SMILES | [2H]C1=C(C(=C(C(=C1N([2H])[2H])[2H])[2H])[N+](=O)[O-])[2H] |
| InChIKey | TYMLOMAKGOJONV-UDDMDDBKSA-N |
Product Overview
Benzen-2,3,5,6-d4-amine-d2, 4-nitro- (CAS 68239-24-7), with molecular formula C6H6N2O2 and molecular weight 144.08 g/mol. IUPAC: N,N,2,3,5,6-hexadeuterio-4-nitroaniline.
Chemical Property Profile of Benzen-2,3,5,6-d4-amine-d2, 4-nitro-
Property Insights of Benzen-2,3,5,6-d4-amine-d2, 4-nitro-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzen-2,3,5,6-d4-amine-d2, 4-nitro-. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzen-2,3,5,6-d4-amine-d2, 4-nitro-. Following Lipinski's Rule of Five, Benzen-2,3,5,6-d4-amine-d2, 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
Frequently Asked Questions
What is the CAS number of Benzen-2,3,5,6-d4-amine-d2, 4-nitro-?
The CAS number of Benzen-2,3,5,6-d4-amine-d2, 4-nitro- is 68239-24-7.
What is the molecular formula of Benzen-2,3,5,6-d4-amine-d2, 4-nitro-?
The molecular formula of Benzen-2,3,5,6-d4-amine-d2, 4-nitro- is C6H6N2O2.
What is the molecular weight of Benzen-2,3,5,6-d4-amine-d2, 4-nitro-?
The molecular weight of Benzen-2,3,5,6-d4-amine-d2, 4-nitro- is 144.08 g/mol.
Where can I buy Benzen-2,3,5,6-d4-amine-d2, 4-nitro-?
You can request a quote for Benzen-2,3,5,6-d4-amine-d2, 4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzen-2,3,5,6-d4-amine-d2, 4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzen-2,3,5,6-d4-amine-d2, 4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.