Chemical ID: 4115721

COC(=O)CSC
Chemical ID:
4115721
Name [?]:
methyl 2-methylsulfanylacetate
SMILES [?]:
COC(=O)CSC
InChi [?]:
InChI=1/C4H8O2S/c1-6-4(5)3-7-2/h3H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,7,5,3,4,2,6/rA:7nCOCOCSC/rB:s1;s2;d3;s3;s5;s6;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C4H8O2S
All Atoms:7
Heavy Atoms:7
Chiral Atoms:0
ZAP Information [?]
Total:4.78448
Area:276.486
Solvation:-2.12767
Coulombic:-18.5102
Bond Count [?]
All:6
Single:5
Double:1
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:120.171
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:0.75
LogP (Chemaxon):0.35

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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