bis[4-(trifluoromethyl)phenyl]ethane-1,2-dione

bis[4-(trifluoromethyl)phenyl]ethane-1,2-dione

CAS: 73790-20-2

Formula: C16H8F6O2

SMILES: FC(F)(F)C1=CC=C(C=C1)C(=O)C(=O)C1=CC=C(C=C1)C(F)(F)F

IUPAC: bis[4-(trifluoromethyl)phenyl]ethane-1,2-dione

InChI: InChI=1S/C16H8F6O2/c17-15(18,19)11-5-1-9(2-6-11)13(23)14(24)10-3-7-12(8-4-10)16(20,21)22/h1-8H

Composition: C (55.51%), H (2.33%), F (32.92%), O (9.24%)

Molar Mass: 346.228

Atom Count: 32

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	346.042848476
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	WHTKSZOXPDAVMH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	74.02
Topological Polar Surface Area	34.14
Polarizability	26.23
Ring Count	2
Rotatable Bond Count	5

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