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2,2-dimethylpropyl 4-(trifluoromethyl)benzoate

2,2-dimethylpropyl 4-(trifluoromethyl)benzoate

Systemtic Name:2,2-dimethylpropyl 4-(trifluoromethyl)benzoate
Openeye Name:2,2-dimethylpropyl 4-(trifluoromethyl)benzoate
CAS Name:4-(trifluoromethyl)benzoic acid 2,2-dimethylpropyl ester
IUPAC Name:2,2-dimethylpropyl 4-(trifluoromethyl)benzoate
Traditional Name:4-(trifluoromethyl)benzoic acid neopentyl ester
Formula: C13H15F3O2
MolecularWeight: 260.25221
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC(=O)C1=CC=C(C=C1)C(F)(F)F


Isomeric SMILES

CC(C)(C)COC(=O)C1=CC=C(C=C1)C(F)(F)F


InChI

InChI=1S/C13H15F3O2/c1-12(2,3)8-18-11(17)9-4-6-10(7-5-9)13(14,15)16/h4-7H,8H2,1-3H3


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