2,4-Dihydroxylamino-6-nitrotoluene
TL;DR: 2,4-Dihydroxylamino-6-nitrotoluene (CAS 185376-54-9) is a chemical compound with molecular formula C7H9N3O4 and molecular weight 199.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(hydroxyamino)-4-methyl-5-nitrophenyl]hydroxylamine
Also Known As: 2,4-Dihydroxylamino-6-nitrotoluene, 2,4-Dihydroxyamino-6-nitrotoluene, c0441, 2,4-dihydroxylamino-6-nitrotoulene, 2,4-dihydroxyamino-1-methyl-6-nitrobenzene
| Molecular Formula | C7H9N3O4 |
|---|---|
| Molecular Weight | 199.06 g/mol |
| LogP | 1.50542 |
| Topological Polar Surface Area | 107.66 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.05931 |
| Heavy Atoms | 14 |
| Complexity | 366.1977 |
Chemical Identifiers
| CAS Number | 185376-54-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1[N+](=O)[O-])NO)NO |
Product Overview
2,4-Dihydroxylamino-6-nitrotoluene (CAS 185376-54-9), with molecular formula C7H9N3O4 and molecular weight 199.06 g/mol. IUPAC: N-[3-(hydroxyamino)-4-methyl-5-nitrophenyl]hydroxylamine.
Chemical Property Profile of 2,4-Dihydroxylamino-6-nitrotoluene
Property Insights of 2,4-Dihydroxylamino-6-nitrotoluene
The XLogP value of 1.50542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dihydroxylamino-6-nitrotoluene. The TPSA of 107.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dihydroxylamino-6-nitrotoluene. Following Lipinski's Rule of Five, 2,4-Dihydroxylamino-6-nitrotoluene has 4 hydrogen bond donor(s) and 6 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 2,4-Dihydroxylamino-6-nitrotoluene?
The CAS number of 2,4-Dihydroxylamino-6-nitrotoluene is 185376-54-9.
What is the molecular formula of 2,4-Dihydroxylamino-6-nitrotoluene?
The molecular formula of 2,4-Dihydroxylamino-6-nitrotoluene is C7H9N3O4.
What is the molecular weight of 2,4-Dihydroxylamino-6-nitrotoluene?
The molecular weight of 2,4-Dihydroxylamino-6-nitrotoluene is 199.06 g/mol.
Where can I buy 2,4-Dihydroxylamino-6-nitrotoluene?
You can request a quote for 2,4-Dihydroxylamino-6-nitrotoluene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dihydroxylamino-6-nitrotoluene?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dihydroxylamino-6-nitrotoluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.