(3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate
TL;DR: (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate (CAS 88599-68-2) is a chemical compound with molecular formula C15H12ClNO4 and molecular weight 305.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methylphenyl) 2-carbamoyloxy-4-chlorobenzoate
Also Known As: (3-methylphenyl)2-carbamoyloxy-4-chlorobenzoate, (3-methylphenyl) 2-carbamoyloxy-4-chlorobenzoate, 4-Chloro-3-methylphenyl 2-((aminocarbonyl)oxy)benzoate, Benzoic acid,2-[(aminocarbonyl)oxy]-, 4-chloro-3-methylphenyl ester, Benzoic acid, 2-((aminocarbonyl)oxy)-, 4-chloro-3-methylphenyl ester
| Molecular Formula | C15H12ClNO4 |
|---|---|
| Molecular Weight | 305.05 g/mol |
| LogP | 3.32512 |
| Topological Polar Surface Area | 78.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.04547 |
| Heavy Atoms | 21 |
| Complexity | 699.823 |
Chemical Identifiers
| CAS Number | 88599-68-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OC(=O)C2=C(C=C(C=C2)Cl)OC(=O)N |
Product Overview
(3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate (CAS 88599-68-2), with molecular formula C15H12ClNO4 and molecular weight 305.05 g/mol. IUPAC: (3-methylphenyl) 2-carbamoyloxy-4-chlorobenzoate.
Chemical Property Profile of (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate
Property Insights of (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate
The XLogP value of 3.32512 indicates that (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.62 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate. Following Lipinski's Rule of Five, (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate has 1 hydrogen bond donor(s) and 4 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 (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate?
The CAS number of (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate is 88599-68-2.
What is the molecular formula of (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate?
The molecular formula of (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate is C15H12ClNO4.
What is the molecular weight of (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate?
The molecular weight of (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate is 305.05 g/mol.
Where can I buy (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate?
You can request a quote for (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (3-Methylphenyl)2-carbamoyloxy-4-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.