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Duplicate ID | |
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CAS Number | 100020-95-9 |
Molecule Name | Octahydro-4H-1,4-ethanoindene-4-carbonyl chloride |
1,4-Ethano-4H-indene-4-carbonyl chloride, octahydro- (9CI) | |
Smiles | O=C(Cl)C12CCC3CCC1C3CCC2 |
InchiKey | JFDNLCLFCJWMAD-UHFFFAOYSA-N |
InChi | InChI=1S/C12H17ClO/c13-11(14)12-6-1-2-9-8(5-7-12)3-4-10(9)12/h8-10H,1-7H2 |
Formula | C12H17ClO |
Molecular weight | 212.716 |
Rings | 3 |
logP | 3.3583 |
PSA | 17.07 |
MR | 58.192 |