4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate
TL;DR: 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate (CAS 57302-74-6) is a chemical compound with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxybut-2-enyl N-(4-chlorophenyl)carbamate
Also Known As: 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate, (E)-4-hydroxy-2-butenyl N-(4-chlorophenyl)carbamate, 4-hydroxybut-2-enyl N-(4-chlorophenyl)carbamate
| Molecular Formula | C11H12ClNO3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 2.437 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 241.05057 |
| Heavy Atoms | 16 |
| Complexity | 361.99734 |
Chemical Identifiers
| CAS Number | 57302-74-6 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)OCC=CCO)Cl |
Product Overview
4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate (CAS 57302-74-6), with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol. IUPAC: 4-hydroxybut-2-enyl N-(4-chlorophenyl)carbamate.
Chemical Property Profile of 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate
Property Insights of 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate
The XLogP value of 2.437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate. With a topological polar surface area (TPSA) of 58.56 Ų, 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate has 2 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 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate?
The CAS number of 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate is 57302-74-6.
What is the molecular formula of 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate?
The molecular formula of 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate is C11H12ClNO3.
What is the molecular weight of 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate?
The molecular weight of 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate is 241.05 g/mol.
Where can I buy 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate?
You can request a quote for 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 4-hydroxybut-2-en-1-yl N-(4-chlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.