CAS: 603-69-0
Название: ethyl 2-acetyl-3-oxobutanoate
SMILES:
CCOC(=O)C(C(=O)C)C(=O)CMolecular Processing
Molecular formula
C8H12O4
Molecular weight
172.18
Exact mass
172.0736
XLogP
0.34
TPSA
60.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
41.49
Supplementary Information
InChIKey: YMCDYRGMTRCAPZ-UHFFFAOYSA-N
Синонимы
603-69-0Ethyl 2-acetylacetoacetateButanoic acid, 2-acetyl-3-oxo-, ethyl esterEINECS 210-053-3DTXSID80209059NSC 345RefChem:594068DTXCID50131550210-053-3Ethyl diacetoacetateEthyl 2-acetyl-3-oxobutanoateEthyl diacetylacetateMFCD00009864K6CX8BFF7J2-acetyl-3-oxobutyric acid ethyl esterAcetoacetic acid, 2-acetyl-, ethyl esterNSC-3452-acetyl-3-oxo-butyric acid ethyl esterEthyl diacetyl acetateethyl 2-acetyl-3-oxo-butanoateethyl diacetyl-acetateUNII-K6CX8BFF7Jethyl 2-acetyl-acetoacetateEthyl diacetoacetate, 97%Diacetylessigsaure-athylesterEthyl2-acetyl-3-oxobutanoateSCHEMBL123766Diacetoacetic Acid Ethyl EsterEthyl 2-Acetyl-3-oxobutyrateethyl 2-acetyl-3-oxo-butyrate
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