CAS: 2850-21-7
名称: ethyl 2-(4-methoxyphenyl)sulfonylacetate
SMILES:
CCOC(=O)CS(=O)(=O)C1=CC=C(C=C1)OCMolecular Processing
Molecular formula
C11H14O5S
Molecular weight
258.29
Exact mass
258.0562
XLogP
1.03
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
61.68
Supplementary Information
InChIKey: HJUXYQLTIVYHIN-UHFFFAOYSA-N
同義語
2850-21-72-[(4-methoxyphenyl)sulfonyl]acetic acid ethyl esterethyl 2-[(4-methoxyphenyl)sulfonyl]acetateETHYL 2-(4-METHOXYBENZENESULFONYL)ACETATEethyl 2-(4-methoxyphenyl)sulfonylacetateEthyl 2-((4-methoxyphenyl)sulfonyl)acetateSCHEMBL5860960DTXSID50363258HJUXYQLTIVYHIN-UHFFFAOYSA-NAKOS005098169Ethyl (4-methoxybenzene-1-sulfonyl)acetateCS-0333363ETHYL2-(4-METHOXYBENZENESULFONYL)ACETATE(4-methoxy-benzenesulfonyl)acetic acid ethyl ester(4-methoxy-phenylsulfonyl)-acetic acid ethyl ester6X-0941F731015(4-methoxy-benzenesulfonyl)-acetic acid ethyl ester2-(4-methoxy-benzenesulfonyl)-acetic acid ethyl ester2-(4-methoxy-benzenesulfonyl)acetic acid ethyl ester
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