1,3-dimethyl 2,2-difluoropropanedioate

1,3-dimethyl 2,2-difluoropropanedioate

CAS: 379-95-3

Formula: C5H6F2O4

SMILES: COC(=O)C(F)(F)C(=O)OC

IUPAC: 1,3-dimethyl 2,2-difluoropropanedioate

InChI: InChI=1S/C5H6F2O4/c1-10-3(8)5(6,7)4(9)11-2/h1-2H3

Composition: C (35.73%), H (3.60%), F (22.60%), O (38.07%)

Molar Mass: 168.096

Atom Count: 17

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	168.023414999
Formal Charge	0
FSP3	0.6
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	NHTZDSRSPCFQCJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	28.64
Topological Polar Surface Area	52.6
Polarizability	11.51
Ring Count	0
Rotatable Bond Count	4

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