phenyl N-(3-chloro-4-fluorophenyl)carbamate
TL;DR: phenyl N-(3-chloro-4-fluorophenyl)carbamate (CAS 77140-73-9) is a chemical compound with molecular formula C13H9ClFNO2 and molecular weight 265.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl N-(3-chloro-4-fluorophenyl)carbamate
Also Known As: phenyl N-(3-chloro-4-fluorophenyl)carbamate, phenyl (3-chloro-4-fluorophenyl)carbamate, phenyl N-(3-chloro-4-fluoro-phenyl)carbamate, N-(3-chloro-4-fluorophenyl)phenoxycarboxamide
| Molecular Formula | C13H9ClFNO2 |
|---|---|
| Molecular Weight | 265.03 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.03058 |
| Heavy Atoms | 18 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 77140-73-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)NC2=CC(=C(C=C2)F)Cl |
| InChIKey | UYMCNKBLWIZQGB-UHFFFAOYSA-N |
Product Overview
phenyl N-(3-chloro-4-fluorophenyl)carbamate (CAS 77140-73-9), with molecular formula C13H9ClFNO2 and molecular weight 265.03 g/mol. IUPAC: phenyl N-(3-chloro-4-fluorophenyl)carbamate.
Chemical Property Profile of phenyl N-(3-chloro-4-fluorophenyl)carbamate
Property Insights of phenyl N-(3-chloro-4-fluorophenyl)carbamate
The XLogP value of 3.8 indicates that phenyl N-(3-chloro-4-fluorophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, phenyl N-(3-chloro-4-fluorophenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, phenyl N-(3-chloro-4-fluorophenyl)carbamate 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 phenyl N-(3-chloro-4-fluorophenyl)carbamate?
The CAS number of phenyl N-(3-chloro-4-fluorophenyl)carbamate is 77140-73-9.
What is the molecular formula of phenyl N-(3-chloro-4-fluorophenyl)carbamate?
The molecular formula of phenyl N-(3-chloro-4-fluorophenyl)carbamate is C13H9ClFNO2.
What is the molecular weight of phenyl N-(3-chloro-4-fluorophenyl)carbamate?
The molecular weight of phenyl N-(3-chloro-4-fluorophenyl)carbamate is 265.03 g/mol.
Where can I buy phenyl N-(3-chloro-4-fluorophenyl)carbamate?
You can request a quote for phenyl N-(3-chloro-4-fluorophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for phenyl N-(3-chloro-4-fluorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for phenyl N-(3-chloro-4-fluorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.