Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester
TL;DR: Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester (CAS 28693-00-7) is a chemical compound with molecular formula C10H13ClO2 and molecular weight 200.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bicyclo[2.2.1]hept-5-enylmethyl 2-chloroacetate
Also Known As: Cyclochloroacetate, Sipomer CCA, CYCLOLCHLOROACETATE, CYCLOL CHLOROACETATE, 5-((Chloroacetoxy)methyl)-2-norbornene
| Molecular Formula | C10H13ClO2 |
|---|---|
| Molecular Weight | 200.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.06041 |
| Heavy Atoms | 13 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 28693-00-7 |
|---|---|
| SMILES | C1C2CC(C1C=C2)COC(=O)CCl |
| InChIKey | YEQPPBCBKNMCKW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester (CAS 28693-00-7), with molecular formula C10H13ClO2 and molecular weight 200.06 g/mol. IUPAC: 2-bicyclo[2.2.1]hept-5-enylmethyl 2-chloroacetate.
Chemical Property Profile of Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester
Property Insights of Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester has 0 hydrogen bond donor(s) and 2 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 Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester?
The CAS number of Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester is 28693-00-7.
What is the molecular formula of Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester?
The molecular formula of Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester is C10H13ClO2.
What is the molecular weight of Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester?
The molecular weight of Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester is 200.06 g/mol.
Where can I buy Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester?
You can request a quote for Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2-chloro-, bicyclo(2.2.1)hept-5-en-2-ylmethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.