4,4,5,5,5-pentafluoropentyl 2-(1H-benzotriazole-1-carbonyl)benzoate
Chemical Structure Depiction of
4,4,5,5,5-pentafluoropentyl 2-(1H-benzotriazole-1-carbonyl)benzoate
4,4,5,5,5-pentafluoropentyl 2-(1H-benzotriazole-1-carbonyl)benzoate
Compound characteristics
Compound ID: | 8010-2961 |
Compound Name: | 4,4,5,5,5-pentafluoropentyl 2-(1H-benzotriazole-1-carbonyl)benzoate |
Molecular Weight: | 427.33 |
Molecular Formula: | C19 H14 F5 N3 O3 |
Smiles: | C(CC(C(F)(F)F)(F)F)COC(c1ccccc1C(n1c2ccccc2nn1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.808 |
logD: | 3.808 |
logSw: | -4.1428 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 60.044 |
InChI Key: | NGDJFKXYJRSWDP-UHFFFAOYSA-N |