CAS: 1071-46-1
名称: 3-ethoxy-3-oxopropanoic acid
SMILES:
CCOC(=O)CC(=O)OMolecular Processing
Molecular formula
C5H8O4
Molecular weight
132.12
Exact mass
132.0423
XLogP
0.02
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
9
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
0.6
Molar refractivity
28.89
Supplementary Information
InChIKey: HGINADPHJQTSKN-UHFFFAOYSA-N
同義語
Ethyl hydrogen malonate1071-46-1Monoethyl malonateE7Y7DZ2K8WDTXSID10147915RefChem:596216DTXCID9070406213-992-73-ethoxy-3-oxopropanoic acidmonoethyl malonic acidmono-Ethyl malonateDescarboxyl Febuxostat(Ethoxycarbonyl)acetic acid3-ethoxy-3-oxo-propanoic acidMonoethyl hydrogen malonatemalonic acid monoethyl esterMFCD00020490malonic acid monoethylester2-(ethoxycarbonyl)acetic acidPropanedioic acid, monoethyl esterethoxycarbonylacetic acid2-(2-Methylpropoxy)-5-(4-methyl-2-thiazolyl)benzonitrile; 2-Isobutoxy-5-(4-methylthiazol-2-yl)benzonitrile;EINECS 213-992-7hydrogen ethyl malonate(Ethoxycarbonyl)acetateethyl hydrogen malonoateMalonic acid ethyl esterMalonic acid, ethyl esterbmse000579SCHEMBL15376
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