CAS: 363-58-6
Название: ethyl 2-chloro-4,4,4-trifluoro-3-oxobutanoate
SMILES:
CCOC(=O)C(C(=O)C(F)(F)F)ClMolecular Processing
Molecular formula
C6H6ClF3O3
Molecular weight
218.56
Exact mass
217.9958
XLogP
1.29
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
37.34
Supplementary Information
InChIKey: YVWUNJVPOCYLIM-UHFFFAOYSA-N
Синонимы
363-58-6ethyl 2-chloro-4,4,4-trifluoro-3-oxobutanoateDTXSID60371884RefChem:342713DTXCID60322917670-525-3ethyl 2-chloro-4,4,4-trifluoroacetoacetateEthyl 2-chloro-3-keto-4,4,4-trifluorobutyrateMFCD00041540Butanoic acid, 2-chloro-4,4,4-trifluoro-3-oxo-, ethyl esterethyl 2-chloro-4,4,4-trifluoro-3-oxo-butanoateSCHEMBL290478ethyl chlorotrifluoroacetoacetate2-chloro-4,4,4-trifluoro-3-oxo-butyric acid ethyl esterSBB032986AKOS000311314SY061817ethyl 4,4,4-trifluoro-2-chloroacetoacetateethyl-2-chloro-4,4,4-trifluoroacetoacetateCS-0121293ST51040032EN300-73576ethyl2-chloro-4,4,4-trifluoro-3-oxobutanoateethyl 2-chloro-4,4,4-trifluoro-3-oxobuta-noateF001496ethyl alpha-chloro-gamma,gamma,gamma-trifluoroacetoacetateEthyl 2-chloro-4,4,4-trifluoro-3-oxobutanoate, AldrichCPREthyl trifluoroacetylchloroacetate; Ethyl 2-chloro-3-keto-4,4,4-trifluorobutyrate; Ethyl 2-chloro-4,4,4-trifluoro-3-oxobutyrate
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