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1,10-dimethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecanedioate

1,10-dimethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecanedioate

CAS: 4590-24-3

Formula: C12H6F16O4

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

IUPAC: 1,10-dimethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecanedioate

InChI: InChI=1S/C12H6F16O4/c1-31-3(29)5(13,14)7(17,18)9(21,22)11(25,26)12(27,28)10(23,24)8(19,20)6(15,16)4(30)32-2/h1-2H3

Composition: C (27.82%), H (1.17%), F (58.67%), O (12.35%)

Molar Mass: 518.15

Atom Count: 38

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 518.001059281
Formal Charge 0
FSP3 0.83
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey VZHNQOSVLFDCLH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 61.32
Topological Polar Surface Area 52.6
Polarizability 24.55
Ring Count 0
Rotatable Bond Count 11

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