Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester
TL;DR: Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester (CAS 63884-49-1) is a chemical compound with molecular formula C10H21NO3 and molecular weight 203.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-ethyl-2-(hydroxymethyl)butyl] N,N-dimethylcarbamate
Also Known As: MC 2679, 2,2-Diethyl-1,3-propanediol dimethylcarbamate, 1,3-Propanediol, 2,2-diethyl-, dimethylcarbamate, CARBAMIC ACID, DIMETHYL-, 2-ETHYL-2-(HYDROXYMETHYL)BUTYL ESTER, Dimethylcarbamic acid, 2-ethyl-2-(hydroxymethyl)butyl ester
| Molecular Formula | C10H21NO3 |
|---|---|
| Molecular Weight | 203.15 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 203.15215 |
| Heavy Atoms | 14 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 63884-49-1 |
|---|---|
| SMILES | CCC(CC)(CO)COC(=O)N(C)C |
| InChIKey | VVNYEECDRVTLHM-UHFFFAOYSA-N |
Product Overview
Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester (CAS 63884-49-1), with molecular formula C10H21NO3 and molecular weight 203.15 g/mol. IUPAC: [2-ethyl-2-(hydroxymethyl)butyl] N,N-dimethylcarbamate.
Chemical Property Profile of Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester
Property Insights of Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester. With a topological polar surface area (TPSA) of 49.8 Ų, Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester has 1 hydrogen bond donor(s) and 3 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 Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester?
The CAS number of Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester is 63884-49-1.
What is the molecular formula of Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester?
The molecular formula of Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester is C10H21NO3.
What is the molecular weight of Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester?
The molecular weight of Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester is 203.15 g/mol.
Where can I buy Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester?
You can request a quote for Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, dimethyl-, 2-ethyl-2-(hydroxymethyl)butyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.