Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester
TL;DR: Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester (CAS 123312-02-7) is a chemical compound with molecular formula C21H17NO5 and molecular weight 363.1107 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-phenoxyphenyl)methyl N-(1,3-benzodioxol-5-yl)carbamate
Also Known As: (3-Phenoxyphenyl)methyl 1,3-benzodioxol-5-ylcarbamate, Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester, (3-Phenoxyphenyl)methyl 2H-1,3-benzodioxol-5-ylcarbamate, (3-phenoxyphenyl)methyl N-(1,3-benzodioxol-5-yl)carbamate
Technical Specifications
| Molecular Formula | C21H17NO5 |
| Molecular Weight | 363.1107 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.1107 Da |
| Heavy Atoms | 27 |
| Complexity | 481.0 |
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)OCC3=CC(=CC=C3)OC4=CC=CC=C4 |
| InChIKey | DOBMQWBPFIDVRO-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester
Property Insights of Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester
The XLogP value of 4.3 indicates that Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester. Following Lipinski's Rule of Five, Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester 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
What is the CAS number of Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester?
The CAS number of Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester is 123312-02-7.
What is the molecular formula of Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester?
The molecular formula of Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester is C21H17NO5.
What is the molecular weight of Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester?
The molecular weight of Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester is 363.1107 g/mol.
Where can I buy Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester?
You can request a quote for Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, 1,3-benzodioxol-5-yl-, (3-phenoxyphenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.