1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate
TL;DR: 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate (CAS 64120-59-8) is a chemical compound with molecular formula C14H20ClNO3 and molecular weight 285.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate
Also Known As: 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate, 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbama, 1-(4-Chloro-2-methylphenoxy)propan-2-yl propan-2-ylcarbamate, CARBAMIC ACID,(1-METHYLETHYL)-, 2-(4-CHLORO-2-METHYLPHENOXY)-1-METHYLETHYL ESTER (9CI)
| Molecular Formula | C14H20ClNO3 |
|---|---|
| Molecular Weight | 285.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.11316 |
| Heavy Atoms | 19 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 64120-59-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OCC(C)OC(=O)NC(C)C |
| InChIKey | KKEYRGHPKHUYNH-UHFFFAOYSA-N |
Product Overview
1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate (CAS 64120-59-8), with molecular formula C14H20ClNO3 and molecular weight 285.11 g/mol. IUPAC: 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate.
Chemical Property Profile of 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate
Property Insights of 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate
The XLogP value of 3.8 indicates that 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate 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 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate?
The CAS number of 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate is 64120-59-8.
What is the molecular formula of 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate?
The molecular formula of 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate is C14H20ClNO3.
What is the molecular weight of 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate?
The molecular weight of 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate is 285.11 g/mol.
Where can I buy 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate?
You can request a quote for 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-chloro-2-methylphenoxy)propan-2-yl N-propan-2-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.