![2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol structure](/static/products/1150/115052-70-5.webp)
2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol
TL;DR: 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol (CAS 115052-70-5) is a chemical compound with molecular formula C10H13N3O6 and molecular weight 271.08044 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4-dinitroanilino)-2-methylpropane-1,3-diol
Also Known As: 2-[(2,4-dinitrophenyl)amino]-2-methylpropane-1,3-diol, Benzeneethanamine,b,4-difluoro, 2-(2,4-dinitroanilino)-2-methylpropane-1,3-diol, BAS 00253658, 1,3-Propanediol, 2-[(2,4-dinitrophenyl)amino]-2-methyl-
Technical Specifications
| Molecular Formula | C10H13N3O6 |
| Molecular Weight | 271.08044 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.08044 Da |
| Heavy Atoms | 19 |
| Complexity | 335.0 |
| SMILES | CC(CO)(CO)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | KNOHINYZYNTSQO-UHFFFAOYSA-N |
Chemical Property Profile of 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol
Property Insights of 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol. The TPSA of 144.0 Ų indicates high polarity, suggesting 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol?
The CAS number of 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol is 115052-70-5.
What is the molecular formula of 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol?
The molecular formula of 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol is C10H13N3O6.
What is the molecular weight of 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol?
The molecular weight of 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol is 271.08044 g/mol.
Where can I buy 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol?
You can request a quote for 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol?
Yes, CoreyChem provides custom synthesis services for 2-[(2,4-Dinitrophenyl)amino]-2-methylpropane-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.