2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate
TL;DR: 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate (CAS 103989-93-1) is a chemical compound with molecular formula C11H15N3O4 and molecular weight 253.10626 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(dimethylamino)ethyl N-(3-nitrophenyl)carbamate
Also Known As: 2-dimethylaminoethyl N-(3-nitrophenyl)carbamate, 666-929-4
Technical Specifications
| Molecular Formula | C11H15N3O4 |
| Molecular Weight | 253.10626 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 87.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 253.10626 Da |
| Heavy Atoms | 18 |
| Complexity | 291.0 |
| SMILES | CN(C)CCOC(=O)NC1=CC(=CC=C1)[N+](=O)[O-] |
| InChIKey | CGPVIASPYQJZNV-UHFFFAOYSA-N |
Chemical Property Profile of 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate
Property Insights of 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate. The TPSA of 87.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate. Following Lipinski's Rule of Five, 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate 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
What is the CAS number of 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate?
The CAS number of 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate is 103989-93-1.
What is the molecular formula of 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate?
The molecular formula of 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate is C11H15N3O4.
What is the molecular weight of 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate?
The molecular weight of 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate is 253.10626 g/mol.
Where can I buy 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate?
You can request a quote for 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate?
Yes, CoreyChem provides custom synthesis services for 2-Dimethylaminoethyl N-(3-nitrophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.