![2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione structure](/static/products/5349/5349-82-6.webp)
2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione
TL;DR: 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione (CAS 5349-82-6) is a chemical compound with molecular formula C12H12ClNO4 and molecular weight 269.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(Z)-3-chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione
Also Known As: AB00082127-01, 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione, 4-[(3-chloro-2-buten-1-yl)oxy]-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione, 4-[(3-chloro-2-butenyl)oxy]-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione, 2-{[(2Z)-3-Chlorobut-2-en-1-yl]oxy}-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
| Molecular Formula | C12H12ClNO4 |
|---|---|
| Molecular Weight | 269.05 g/mol |
| LogP | 0.999 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.04547 |
| Heavy Atoms | 18 |
| Complexity | 438.69788 |
Chemical Identifiers
| CAS Number | 5349-82-6 |
|---|---|
| SMILES | C/C(=C/CON1C(=O)C2C3C=CC(C2C1=O)O3)/Cl |
Product Overview
2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione (CAS 5349-82-6), with molecular formula C12H12ClNO4 and molecular weight 269.05 g/mol. IUPAC: 2-[(Z)-3-chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione.
Chemical Property Profile of 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione
Property Insights of 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione
The XLogP value of 0.999 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione. With a topological polar surface area (TPSA) of 55.84 Ų, 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione has 0 hydrogen bond donor(s) and 4 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 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione?
The CAS number of 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione is 5349-82-6.
What is the molecular formula of 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione?
The molecular formula of 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione is C12H12ClNO4.
What is the molecular weight of 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione?
The molecular weight of 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione is 269.05 g/mol.
Where can I buy 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione?
You can request a quote for 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Z)-3-Chlorobut-2-enoxy]-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.