Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate
TL;DR: Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate (CAS 2794-55-0) is a chemical compound with molecular formula C10H11ClFNO2 and molecular weight 231.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-(3-chloro-2-fluorophenyl)carbamate
Also Known As: propan-2-yl(3-chloro-2-fluorophenyl)carbamate, isopropyl (3-chloro-2-fluorophenyl)carbamate, propan-2-yl N-(3-chloro-2-fluorophenyl)carbamate, Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate
| Molecular Formula | C10H11ClFNO2 |
|---|---|
| Molecular Weight | 231.05 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.04623 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 2794-55-0 |
|---|---|
| SMILES | CC(C)OC(=O)NC1=C(C(=CC=C1)Cl)F |
| InChIKey | YJFZTAPBYOFSGC-UHFFFAOYSA-N |
Product Overview
Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate (CAS 2794-55-0), with molecular formula C10H11ClFNO2 and molecular weight 231.05 g/mol. IUPAC: propan-2-yl N-(3-chloro-2-fluorophenyl)carbamate.
Chemical Property Profile of Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate
Property Insights of Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate
The XLogP value of 3.0 indicates that Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate 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 Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate?
The CAS number of Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate is 2794-55-0.
What is the molecular formula of Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate?
The molecular formula of Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate is C10H11ClFNO2.
What is the molecular weight of Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate?
The molecular weight of Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate is 231.05 g/mol.
Where can I buy Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate?
You can request a quote for Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-yl hydrogen (3-chloro-2-fluorophenyl)carbonimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.