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methyl 3,4-dibromo-2,2,3,4,4-pentafluorobutanoate

methyl 3,4-dibromo-2,2,3,4,4-pentafluorobutanoate

CAS: 124311-13-3

Formula: C5H3Br2F5O2

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

IUPAC: methyl 3,4-dibromo-2,2,3,4,4-pentafluorobutanoate

InChI: InChI=1/C5H3Br2F5O2/c1-14-2(13)3(8,9)4(6,10)5(7,11)12/h1H3

Composition: C (17.16%), H (0.86%), Br (45.68%), F (27.15%), O (9.15%)

Molar Mass: 349.877

Atom Count: 17

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 347.841996
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey WJHDKPUBABRPCK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.14
Topological Polar Surface Area 26.3
Polarizability 17.12
Ring Count 0
Rotatable Bond Count 4

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