ethyl 4,4-difluoro-3-oxobutanoate

ethyl 4,4-difluoro-3-oxobutanoate

CAS: 352-24-9

Formula: C6H8F2O3

SMILES: CCOC(=O)CC(=O)C(F)F

IUPAC: ethyl 4,4-difluoro-3-oxobutanoate

InChI: InChI=1S/C6H8F2O3/c1-2-11-5(10)3-4(9)6(7)8/h6H,2-3H2,1H3

Composition: C (43.38%), H (4.85%), F (22.87%), O (28.89%)

Molar Mass: 166.124

Atom Count: 19

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	166.044150444
Formal Charge	0
FSP3	0.67
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CBDPWKVOPADMJC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	32.2
Topological Polar Surface Area	43.37
Polarizability	12.45
Ring Count	0
Rotatable Bond Count	5

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