(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate
TL;DR: (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate (CAS 4934-23-0) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dimethyl-1,3-dioxolan-4-yl)methyl 2-aminobenzoate
Also Known As: (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl 2-aminobenzoate, 2,2-Dimethyl-1,3-dioxolane-4-methanol 2-aminobenzoate, 225-572-0, EINECS 225-572-0
| Molecular Formula | C13H17NO4 |
|---|---|
| Molecular Weight | 251.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.11575 |
| Heavy Atoms | 18 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 4934-23-0 |
|---|---|
| SMILES | CC1(OCC(O1)COC(=O)C2=CC=CC=C2N)C |
| InChIKey | CPBQBOCHNODNFX-UHFFFAOYSA-N |
Product Overview
(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate (CAS 4934-23-0), with molecular formula C13H17NO4 and molecular weight 251.12 g/mol. IUPAC: (2,2-dimethyl-1,3-dioxolan-4-yl)methyl 2-aminobenzoate.
Chemical Property Profile of (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate
Property Insights of (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate. Following Lipinski's Rule of Five, (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate has 1 hydrogen bond donor(s) and 5 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 (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate?
The CAS number of (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate is 4934-23-0.
What is the molecular formula of (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate?
The molecular formula of (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate is C13H17NO4.
What is the molecular weight of (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate?
The molecular weight of (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate is 251.12 g/mol.
Where can I buy (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate?
You can request a quote for (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate?
Yes, KEHONG BIO provides custom synthesis services for (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl anthranilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.