2-[2,5-bis(trifluoromethyl)phenyl]acetaldehyde

2-[2,5-bis(trifluoromethyl)phenyl]acetaldehyde

CAS: 1260878-79-2

Formula: C10H6F6O

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

IUPAC: 2-[2,5-bis(trifluoromethyl)phenyl]acetaldehyde

InChI: InChI=1S/C10H6F6O/c11-9(12,13)7-1-2-8(10(14,15)16)6(5-7)3-4-17/h1-2,4-5H,3H2

Composition: C (46.89%), H (2.36%), F (44.50%), O (6.25%)

Molar Mass: 256.147

Atom Count: 23

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	256.032283791
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	VGZYUKBKRUURQG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.39
Topological Polar Surface Area	17.07
Polarizability	16.91
Ring Count	1
Rotatable Bond Count	4

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