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methyl 2,2,3,3,4,4-hexafluorobutanoate

methyl 2,2,3,3,4,4-hexafluorobutanoate

CAS: 356-32-1

Formula: C5H4F6O2

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

IUPAC: methyl 2,2,3,3,4,4-hexafluorobutanoate

InChI: InChI=1S/C5H4F6O2/c1-13-3(12)5(10,11)4(8,9)2(6)7/h2H,1H3

Composition: C (28.59%), H (1.92%), F (54.26%), O (15.23%)

Molar Mass: 210.075

Atom Count: 17

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 210.011548347
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey GUDSBACGSFZSPH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 26.87
Topological Polar Surface Area 26.3
Polarizability 10.68
Ring Count 0
Rotatable Bond Count 4

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Purity (%)
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 356-32-1 $88.49-$619.45$88.49$88.49$353.97$353.97$619.45$619.45
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