Compound C11H9F6NO4

4,4,4-trifluoro-1-(3-nitrophenyl)-3-(trifluoromethyl)butane-1,3-diol

CAS: 34848-25-4

Molecular Formula	`C11H9F6NO4`
Molecular Weight	333.18 g/mol
LogP	2.7
Topological Polar Surface Area	86.3 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	10
Rotatable Bonds	3
Exact Mass	333.04358
Heavy Atoms	22
Complexity	391.0

Chemical Identifiers

CAS Number	34848-25-4
SMILES	`C1=CC(=CC(=C1)[N+](=O)[O-])C(CC(C(F)(F)F)(C(F)(F)F)O)O`
InChIKey	`FJTBLBJDWDDWKA-UHFFFAOYSA-N`

📖 Product Overview

Compound C11H9F6NO4 (CAS: 34848-25-4) is a chemical compound with molecular formula C11H9F6NO4 and molecular weight 333.18 g/mol. Its IUPAC systematic name is 4,4,4-trifluoro-1-(3-nitrophenyl)-3-(trifluoromethyl)butane-1,3-diol. LogP 2.7 Topological Polar Surface Area 86.3 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 10 Rotatable Bonds 3 Exact Mass 333.04358 Heavy Atoms 22 Complexity 391.0 InChI Key: FJTBLBJDWDDWKA-UHFFFAOYSA-N. SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(CC(C(F)(F)F)(C(F)(F)F)O)O.

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