N-(Hydroxymethyl)-4-nitrophthalimide
TL;DR: N-(Hydroxymethyl)-4-nitrophthalimide (CAS 22546-83-4) is a chemical compound with molecular formula C9H6N2O5 and molecular weight 222.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-5-nitroisoindole-1,3-dione
Also Known As: N-(Hydroxymethyl)-4-nitrophthalimide, 2-(hydroxymethyl)-5-nitroisoindoline-1,3-dione, N-hydroxymethyl-3-nitrophthalimide, 2-(hydroxymethyl)-5-nitro-2,3-dihydro-1H-isoindole-1,3-dione, J1.379.502I
| Molecular Formula | C9H6N2O5 |
|---|---|
| Molecular Weight | 222.03 g/mol |
| LogP | 0.1406 |
| Topological Polar Surface Area | 100.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.02766 |
| Heavy Atoms | 16 |
| Complexity | 510.62085 |
Chemical Identifiers
| CAS Number | 22546-83-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CO |
Product Overview
N-(Hydroxymethyl)-4-nitrophthalimide (CAS 22546-83-4), with molecular formula C9H6N2O5 and molecular weight 222.03 g/mol. IUPAC: 2-(hydroxymethyl)-5-nitroisoindole-1,3-dione.
Chemical Property Profile of N-(Hydroxymethyl)-4-nitrophthalimide
Property Insights of N-(Hydroxymethyl)-4-nitrophthalimide
The XLogP value of 0.1406 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Hydroxymethyl)-4-nitrophthalimide. The TPSA of 100.75 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(Hydroxymethyl)-4-nitrophthalimide. Following Lipinski's Rule of Five, N-(Hydroxymethyl)-4-nitrophthalimide has 1 hydrogen bond donor(s) and 5 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-(Hydroxymethyl)-4-nitrophthalimide?
The CAS number of N-(Hydroxymethyl)-4-nitrophthalimide is 22546-83-4.
What is the molecular formula of N-(Hydroxymethyl)-4-nitrophthalimide?
The molecular formula of N-(Hydroxymethyl)-4-nitrophthalimide is C9H6N2O5.
What is the molecular weight of N-(Hydroxymethyl)-4-nitrophthalimide?
The molecular weight of N-(Hydroxymethyl)-4-nitrophthalimide is 222.03 g/mol.
Where can I buy N-(Hydroxymethyl)-4-nitrophthalimide?
You can request a quote for N-(Hydroxymethyl)-4-nitrophthalimide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Hydroxymethyl)-4-nitrophthalimide?
Yes, KEHONG BIO provides custom synthesis services for N-(Hydroxymethyl)-4-nitrophthalimide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.