3,3-dibromo-1,1,1-trifluoropropan-2-one

3,3-dibromo-1,1,1-trifluoropropan-2-one

CAS: 431-67-4

Formula: C3HBr2F3O

SMILES: FC(F)(F)C(=O)C(Br)Br

IUPAC: 3,3-dibromo-1,1,1-trifluoropropan-2-one

InChI: InChI=1S/C3HBr2F3O/c4-2(5)1(9)3(6,7)8/h2H

Composition: C (13.35%), H (0.37%), Br (59.22%), F (21.12%), O (5.93%)

Molar Mass: 269.843

Atom Count: 10

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	267.834625
Formal Charge	0
FSP3	0.67
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	HEPPAPZASXFWTB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	32.81
Topological Polar Surface Area	17.07
Polarizability	12.73
Ring Count	0
Rotatable Bond Count	2

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