4-Amino-3-nitro-5-beta-hydroxypropylaniline
TL;DR: 4-Amino-3-nitro-5-beta-hydroxypropylaniline (CAS 104535-31-1) is a chemical compound with molecular formula C9H13N3O3 and molecular weight 211.09569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,5-diamino-3-nitrophenyl)propan-2-ol
Also Known As: 1-(2,5-diamino-3-nitrophenyl)propan-2-ol, 4-Amino-3-nitro-5-beta-hydroxypropylaniline, Propanedioic acid, (5-nitro-3-thienyl)-, 2,5-Diamino-3-nitro-alpha-methylbenzeneethanol, 2,5-Diamino-alpha-methyl-3-nitrobenzeneethanol
Technical Specifications
| Molecular Formula | C9H13N3O3 |
| Molecular Weight | 211.09569 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.09569 Da |
| Heavy Atoms | 15 |
| Complexity | 231.0 |
| SMILES | CC(CC1=C(C(=CC(=C1)N)[N+](=O)[O-])N)O |
| InChIKey | MXOCSXVBYBYNOZ-UHFFFAOYSA-N |
Chemical Property Profile of 4-Amino-3-nitro-5-beta-hydroxypropylaniline
Property Insights of 4-Amino-3-nitro-5-beta-hydroxypropylaniline
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-3-nitro-5-beta-hydroxypropylaniline. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-3-nitro-5-beta-hydroxypropylaniline. Following Lipinski's Rule of Five, 4-Amino-3-nitro-5-beta-hydroxypropylaniline has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Amino-3-nitro-5-beta-hydroxypropylaniline?
The CAS number of 4-Amino-3-nitro-5-beta-hydroxypropylaniline is 104535-31-1.
What is the molecular formula of 4-Amino-3-nitro-5-beta-hydroxypropylaniline?
The molecular formula of 4-Amino-3-nitro-5-beta-hydroxypropylaniline is C9H13N3O3.
What is the molecular weight of 4-Amino-3-nitro-5-beta-hydroxypropylaniline?
The molecular weight of 4-Amino-3-nitro-5-beta-hydroxypropylaniline is 211.09569 g/mol.
Where can I buy 4-Amino-3-nitro-5-beta-hydroxypropylaniline?
You can request a quote for 4-Amino-3-nitro-5-beta-hydroxypropylaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Amino-3-nitro-5-beta-hydroxypropylaniline?
Yes, CoreyChem provides custom synthesis services for 4-Amino-3-nitro-5-beta-hydroxypropylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.