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1,8-dimethyl 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluorooctanedioate

1,8-dimethyl 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluorooctanedioate

CAS: 2062-20-6

Formula: C10H6F12O4

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

IUPAC: 1,8-dimethyl 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluorooctanedioate

InChI: InChI=1S/C10H6F12O4/c1-25-3(23)5(11,12)7(15,16)9(19,20)10(21,22)8(17,18)6(13,14)4(24)26-2/h1-2H3

Composition: C (28.73%), H (1.45%), F (54.52%), O (15.31%)

Molar Mass: 418.135

Atom Count: 32

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 418.007446629
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey SLFDDMXEAUAENU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.98
Topological Polar Surface Area 52.6
Polarizability 20.76
Ring Count 0
Rotatable Bond Count 9

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