Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-
TL;DR: Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- (CAS 71832-33-2) is a chemical compound with molecular formula C11H11ClN2O2 and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-(5-isocyanato-2-methylphenyl)carbamoyl chloride
Also Known As: Carbamic chloride, ethyl(5-isocyanato-2-methylphenyl)-, Ethyl(2-methyl-5-isocyanatophenyl)carbamyl chloride, Ethyl(5-isocyanato-2-methylphenyl)carbamoyl chloride, Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-, ethyl(5-isocyanato-2-methylphenyl)carbamic chloride
| Molecular Formula | C11H11ClN2O2 |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.0509 |
| Heavy Atoms | 16 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 71832-33-2 |
|---|---|
| SMILES | CCN(C1=C(C=CC(=C1)N=C=O)C)C(=O)Cl |
| InChIKey | JZKGLBABVFZFIL-UHFFFAOYSA-N |
Product Overview
Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- (CAS 71832-33-2), with molecular formula C11H11ClN2O2 and molecular weight 238.05 g/mol. IUPAC: N-ethyl-N-(5-isocyanato-2-methylphenyl)carbamoyl chloride.
Chemical Property Profile of Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-
Property Insights of Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-
The XLogP value of 3.9 indicates that Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- has 0 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 chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-?
The CAS number of Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- is 71832-33-2.
What is the molecular formula of Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-?
The molecular formula of Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- is C11H11ClN2O2.
What is the molecular weight of Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-?
The molecular weight of Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- is 238.05 g/mol.
Where can I buy Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-?
You can request a quote for Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Carbamic chloride, N-ethyl-N-(5-isocyanato-2-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.