Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester
TL;DR: Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester (CAS 88599-34-2) is a chemical compound with molecular formula C29H41NO4 and molecular weight 467.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-pentadecylphenyl) 2-carbamoyloxybenzoate
Also Known As: 3-Pentadecylphenyl 2-((aminocarbonyl)oxy)benzoate, Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester, (3-pentadecylphenyl) 2-carbamoyloxybenzoate, 3-PENTADECYLPHENYL 2-(CARBAMOYLOXY)BENZOATE, BRN 6004522
| Molecular Formula | C29H41NO4 |
|---|---|
| Molecular Weight | 467.30 g/mol |
| LogP | 7.997 |
| Topological Polar Surface Area | 78.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 467.30356 |
| Heavy Atoms | 34 |
| Complexity | 864.71405 |
Chemical Identifiers
| CAS Number | 88599-34-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(=O)C2=CC=CC=C2OC(=O)N |
Product Overview
Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester (CAS 88599-34-2), with molecular formula C29H41NO4 and molecular weight 467.30 g/mol. IUPAC: (3-pentadecylphenyl) 2-carbamoyloxybenzoate.
Chemical Property Profile of Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester
Property Insights of Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester
The XLogP value of 7.997 indicates that Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester 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 Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester. Following Lipinski's Rule of Five, Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester?
The CAS number of Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester is 88599-34-2.
What is the molecular formula of Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester?
The molecular formula of Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester is C29H41NO4.
What is the molecular weight of Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester?
The molecular weight of Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester is 467.30 g/mol.
Where can I buy Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester?
You can request a quote for Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-((aminocarbonyl)oxy)-, 3-pentadecylphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.