2-oxo-2-[3-(trifluoromethyl)phenyl]acetaldehyde

2-oxo-2-[3-(trifluoromethyl)phenyl]acetaldehyde

CAS: 38923-38-5

Formula: C9H5F3O2

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

IUPAC: 2-oxo-2-[3-(trifluoromethyl)phenyl]acetaldehyde

InChI: InChI=1S/C9H5F3O2/c10-9(11,12)7-3-1-2-6(4-7)8(14)5-13/h1-5H

Composition: C (53.48%), H (2.49%), F (28.20%), O (15.83%)

Molar Mass: 202.132

Atom Count: 19

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	202.02416389
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KSLRFRNLMJHNLZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.29
Topological Polar Surface Area	34.14
Polarizability	15.45
Ring Count	1
Rotatable Bond Count	3

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