Chemical ID: 4950619

CC(C)CCCCCOC(=O)c1ccccc1SSc2ccccc2C(=O)OCCCCCC(C)C
Chemical ID:
4950619
Name [?]:
6-methylheptyl 2-[2-(6-methylheptoxycarbonyl)phenyl]disulfanylbenzoate
SMILES [?]:
CC(C)CCCCCOC(=O)c1ccccc1SSc2ccccc2C(=O)OCCCCCC(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H42O4S2
All Atoms:36
Heavy Atoms:36
Chiral Atoms:0
ZAP Information [?]
Total:19.1382
Area:869.552
Solvation:-2.60062
Coulombic:-46.2867
Bond Count [?]
All:37
Single:29
Double:8
Rotors:19
Chiral:0
Rigid Segments:13
Chemical Properties
Molecular Weight:530.784
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:10.42
LogP (Chemaxon):8.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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