![(1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid structure](/static/products/121/1214622-78-2.webp)
(1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
TL;DR: (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid (CAS 1214622-78-2) is a chemical compound with molecular formula C12H13ClO4 and molecular weight 256.05023 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-(2-chloroprop-2-enoxycarbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, (3S)-3-(2-chloroprop-2-enoxycarbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Technical Specifications
| Molecular Formula | C12H13ClO4 |
| Molecular Weight | 256.05023 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.05023 Da |
| Heavy Atoms | 17 |
| Complexity | 401.0 |
| SMILES | C=C(COC(=O)[C@H]1C2CC(C1C(=O)O)C=C2)Cl |
| InChIKey | JDQQHYBAWBPWFX-VVIYDGDNSA-N |
Chemical Property Profile of (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Property Insights of (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid. Following Lipinski's Rule of Five, (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid?
The CAS number of (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid is 1214622-78-2.
What is the molecular formula of (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid?
The molecular formula of (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid is C12H13ClO4.
What is the molecular weight of (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid?
The molecular weight of (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid is 256.05023 g/mol.
Where can I buy (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid?
You can request a quote for (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for (1R,2R,4S)-3-(((2-chloroallyl)oxy)carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.