Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester
TL;DR: Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester (CAS 123312-11-8) is a chemical compound with molecular formula C18H14F5NO4 and molecular weight 403.0843 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,3,4,5,6-pentafluorophenyl)methyl N-(1,3-benzodioxol-5-yl)-N-propan-2-ylcarbamate
Also Known As: Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester, (Pentafluorophenyl)methyl 2H-1,3-benzodioxol-5-yl(propan-2-yl)carbamate, (2,3,4,5,6-pentafluorophenyl)methyl N-(1,3-benzodioxol-5-yl)-N-propan-2-ylcarbamate
Technical Specifications
| Molecular Formula | C18H14F5NO4 |
| Molecular Weight | 403.0843 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.0843 Da |
| Heavy Atoms | 28 |
| Complexity | 540.0 |
| SMILES | CC(C)N(C1=CC2=C(C=C1)OCO2)C(=O)OCC3=C(C(=C(C(=C3F)F)F)F)F |
| InChIKey | IXGPQXYFMJQVOT-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester
Property Insights of Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester
The XLogP value of 4.3 indicates that Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester has 0 hydrogen bond donor(s) and 9 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(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester?
The CAS number of Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester is 123312-11-8.
What is the molecular formula of Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester?
The molecular formula of Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester is C18H14F5NO4.
What is the molecular weight of Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester?
The molecular weight of Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester is 403.0843 g/mol.
Where can I buy Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester?
You can request a quote for Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)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(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, 1,3-benzodioxol-5-yl(1-methylethyl)-, (2,3,4,5,6-pentafluorophenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.