Butyl N-(2,4-xylyl)carbamate
TL;DR: Butyl N-(2,4-xylyl)carbamate (CAS 113579-11-6) is a chemical compound with molecular formula C13H19NO2 and molecular weight 221.14159 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butyl N-(2,4-dimethylphenyl)carbamate
Also Known As: butyl (2,4-dimethylphenyl)carbamate, butyl N-(2,4-dimethylphenyl)carbamate, BUTYL N-(2,4-XYLYL)CARBAMATE, Carbamic acid, 2,4-dimethylphenyl, butyl ester, N-(2,4-dimethylphenyl)butoxycarboxamide
Technical Specifications
| Molecular Formula | C13H19NO2 |
| Molecular Weight | 221.14159 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.14159 Da |
| Heavy Atoms | 16 |
| Complexity | 218.0 |
| SMILES | CCCCOC(=O)NC1=C(C=C(C=C1)C)C |
| InChIKey | JRICEOSBCKGWME-UHFFFAOYSA-N |
Chemical Property Profile of Butyl N-(2,4-xylyl)carbamate
Property Insights of Butyl N-(2,4-xylyl)carbamate
The XLogP value of 3.1 indicates that Butyl N-(2,4-xylyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Butyl N-(2,4-xylyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl N-(2,4-xylyl)carbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Butyl N-(2,4-xylyl)carbamate?
The CAS number of Butyl N-(2,4-xylyl)carbamate is 113579-11-6.
What is the molecular formula of Butyl N-(2,4-xylyl)carbamate?
The molecular formula of Butyl N-(2,4-xylyl)carbamate is C13H19NO2.
What is the molecular weight of Butyl N-(2,4-xylyl)carbamate?
The molecular weight of Butyl N-(2,4-xylyl)carbamate is 221.14159 g/mol.
Where can I buy Butyl N-(2,4-xylyl)carbamate?
You can request a quote for Butyl N-(2,4-xylyl)carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butyl N-(2,4-xylyl)carbamate?
Yes, CoreyChem provides custom synthesis services for Butyl N-(2,4-xylyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.