名称: S-ethyl 2-[(4R)-2,2-dimethyl-5-oxo-1,3-dioxolan-4-yl]ethanethioate
SMILES:
CCSC(=O)CC1C(=O)OC(O1)(C)CMolecular Processing
Molecular formula
C9H14O4S
Molecular weight
218.27
Exact mass
218.0613
XLogP
1.33
TPSA
52.6
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
52.8
Supplementary Information
InChIKey: RGKKSBGKWUQYLH-ZCFIWIBFSA-N
同義語
SCHEMBL826291RGKKSBGKWUQYLH-ZCFIWIBFSA-N(R)-S-Ethyl 2-(2,2-dimethyl-5-oxo-1,3-dioxolan-4-yl)ethanethioate(R) -S-Ethyl 2-(2,2-dimethyl-5-oxo-1,3-dioxolan-4-yl)ethanethioate
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