AC1LBQYS
(3,4,5,6,13,13-hexachloro-10-oxapentacyclo[6.3.1.13,6.02,7.09,11]tridec-4-en-12-yl) acetate
Also Known As: 2,7:3,6-Dimethanonaphth[2,3-b]oxiren-8-ol, 3,4,5,6,9,9-hexachloro-1a,2,2a,3,6,6a,7,7a-octahydro-, acetate, stereoisomer|3,4,5,6,13,13-hexachloro-10-oxapentacyclo[6.3.1.13,6.02,7.09,11]tridec-4-en-12-yl acetate|Acetic acid 3,4,5,6,9,9-hexachloro-1a,2,2a,3,6,6a,7,7a-octahydro-2,7:3,6-dimethanonaphth[2,3-b]oxiren-8-yl ester|Aceticacid3,4,5,6,9,9-hexachloro-1a,2,2a,3,6,6a,7,7a-octahydro-2,7:3,6-dimethanonaphth[2,3-b]oxiren-8-ylester
| Molecular Formula | C14H10Cl6O3 |
|---|---|
| Molecular Weight | 435.8761 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 435.8761 |
| Monoisotopic Mass | 435.8761 |
| Heavy Atoms | 23 |
| Complexity | 648.0 |
Chemical Identifiers
| CAS Number | 55649-85-9 |
|---|---|
| SMILES | CC(=O)OC1C2C3C(C1C4C2O4)C5(C(=C(C3(C5(Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | HCTVFZUTZGCEPG-UHFFFAOYSA-N |
Product Overview
AC1LBQYS (CAS 55649-85-9), with molecular formula C14H10Cl6O3 and molecular weight 435.8761 g/mol. IUPAC: (3,4,5,6,13,13-hexachloro-10-oxapentacyclo[6.3.1.13,6.02,7.09,11]tridec-4-en-12-yl) acetate.
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