Chemical ID: 4084992

CC(=O)C(=C(SC)SC)C(=O)c1ccccc1
Chemical ID:
4084992
Name [?]:
2-[bis(methylsulfanyl)methylene]-1-phenyl-butane-1,3-dione
SMILES [?]:
CC(=O)C(=C(SC)SC)C(=O)c1ccccc1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H14O2S2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.23843
Area:436.019
Solvation:-2.66204
Coulombic:-17.83
Bond Count [?]
All:17
Single:11
Double:6
Rotors:5
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:266.381
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.68
LogP (Chemaxon):3.8

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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