1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate
TL;DR: 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate (CAS 6105-47-1) is a chemical compound with molecular formula C13H18ClNO3 and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-chloro-3-propan-2-yloxypropan-2-yl) N-phenylcarbamate
Also Known As: 1-chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate, (1-chloro-3-propan-2-yloxypropan-2-yl) N-phenylcarbamate, Propiophenone,4'-hexyloxy-3-piperidino-,hydrochloride, 1-Chloro-3-[(propan-2-yl)oxy]propan-2-yl phenylcarbamate
| Molecular Formula | C13H18ClNO3 |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 271.09753 |
| Heavy Atoms | 18 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 6105-47-1 |
|---|---|
| SMILES | CC(C)OCC(CCl)OC(=O)NC1=CC=CC=C1 |
| InChIKey | JOUQKJFCPAXJMK-UHFFFAOYSA-N |
Product Overview
1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate (CAS 6105-47-1), with molecular formula C13H18ClNO3 and molecular weight 271.10 g/mol. IUPAC: (1-chloro-3-propan-2-yloxypropan-2-yl) N-phenylcarbamate.
Chemical Property Profile of 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate
Property Insights of 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate
The XLogP value of 3.1 indicates that 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate 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-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate 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-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate?
The CAS number of 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate is 6105-47-1.
What is the molecular formula of 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate?
The molecular formula of 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate is C13H18ClNO3.
What is the molecular weight of 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate?
The molecular weight of 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate is 271.10 g/mol.
Where can I buy 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate?
You can request a quote for 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-3-(propan-2-yloxy)propan-2-yl phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.