(3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate
TL;DR: (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate (CAS 77378-97-3) is a chemical compound with molecular formula C21H20Br2Cl2O3 and molecular weight 547.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate
Also Known As: (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate, (3-Phenoxyphenyl)methyl 3-(1,2-dibromo-2,2-dichloroethyl)-2,2-dimethylcyclopropane-1-carboxylate, 3-phenoxybenzyl(1r)-3-[(1s)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropanecarboxylate, Cyclopropanecarboxylic acid, 3-(1,2-dibromo-2,2-dichloroethyl)-2,2-dimethyl-, (3-phenoxyphenyl)methyl ester, (1R-(1alpha,3alpha(S*)))-
| Molecular Formula | C21H20Br2Cl2O3 |
|---|---|
| Molecular Weight | 547.92 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 547.91565 |
| Heavy Atoms | 28 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 77378-97-3 |
|---|---|
| SMILES | CC1([C@@H](C1[C@@H](C(Cl)(Cl)Br)Br)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C |
| InChIKey | FZJLQMVKWOMGPV-FQECFTEESA-N |
Product Overview
(3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate (CAS 77378-97-3), with molecular formula C21H20Br2Cl2O3 and molecular weight 547.92 g/mol. IUPAC: (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate.
Chemical Property Profile of (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate
Property Insights of (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate
The XLogP value of 7.2 indicates that (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate?
The CAS number of (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate is 77378-97-3.
What is the molecular formula of (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate?
The molecular formula of (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate is C21H20Br2Cl2O3.
What is the molecular weight of (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate?
The molecular weight of (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate is 547.92 g/mol.
Where can I buy (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate?
You can request a quote for (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (3-phenoxyphenyl)methyl (1R)-3-[(1S)-1,2-dibromo-2,2-dichloroethyl]-2,2-dimethylcyclopropane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.