二甲基氨基甲酸邻亚苯酯(2:1)
TL;DR: 二甲基氨基甲酸邻亚苯酯(2:1) (CAS 63884-50-4) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二甲基氨基甲酸邻亚苯酯(2:1)
[2-(dimethylcarbamoyloxy)phenyl] N,N-dimethylcarbamate
Also Known As: NIOSH/FA2747000, Benzene, 1,2-bis(dimethylcarbamyloxy)-, Dimethylcarbamic acid o-phenylene ester, TL 1015, 1,2-Phenylene bis(dimethylcarbamate)
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 63884-50-4 |
|---|---|
| SMILES | CN(C)C(=O)OC1=CC=CC=C1OC(=O)N(C)C |
| InChIKey | FZGVIEAHUXJJJI-UHFFFAOYSA-N |
Product Overview
二甲基氨基甲酸邻亚苯酯(2:1) (CAS 63884-50-4), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: [2-(dimethylcarbamoyloxy)phenyl] N,N-dimethylcarbamate.
Chemical Property Profile of 二甲基氨基甲酸邻亚苯酯(2:1)
Property Insights of 二甲基氨基甲酸邻亚苯酯(2:1)
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二甲基氨基甲酸邻亚苯酯(2:1). With a topological polar surface area (TPSA) of 59.1 Ų, 二甲基氨基甲酸邻亚苯酯(2:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二甲基氨基甲酸邻亚苯酯(2:1) has 0 hydrogen bond donor(s) and 4 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 二甲基氨基甲酸邻亚苯酯(2:1)?
The CAS number of 二甲基氨基甲酸邻亚苯酯(2:1) is 63884-50-4.
What is the molecular formula of 二甲基氨基甲酸邻亚苯酯(2:1)?
The molecular formula of 二甲基氨基甲酸邻亚苯酯(2:1) is C12H16N2O4.
What is the molecular weight of 二甲基氨基甲酸邻亚苯酯(2:1)?
The molecular weight of 二甲基氨基甲酸邻亚苯酯(2:1) is 252.11 g/mol.
Where can I buy 二甲基氨基甲酸邻亚苯酯(2:1)?
You can request a quote for 二甲基氨基甲酸邻亚苯酯(2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二甲基氨基甲酸邻亚苯酯(2:1)?
Yes, KEHONG BIO provides custom synthesis services for 二甲基氨基甲酸邻亚苯酯(2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.