Chemical ID: 4904886

c1ccc(c(c1)O)S(=O)S(=O)c2ccccc2O
Chemical ID:
4904886
Name [?]:
2-(2-hydroxyphenyl)sulfinylsulfinylphenol
SMILES [?]:
c1ccc(c(c1)O)S(=O)S(=O)c2ccccc2O
InChi [?]:
InChI=1/C12H10O4S2/c13-9-5-1-3-7-11(9)17(15)18(16)12-8-4-2-6-10(12)14/h1-8,13-14H
InChi Info:
AuxInfo=1/0/N:1,15,2,14,6,16,3,13,5,17,4,12,7,18,9,11,8,10/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)/rA:18cCCCCCCOSOSOCCCCCCO/rB:s1;d2;s3;d4;d1s5;s5;s4;d8;s8;d10;s10;s12;d13;s14;d15;d12s16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H10O4S2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.95531
Area:429.335
Solvation:-3.77806
Coulombic:-43.4773
Bond Count [?]
All:19
Single:11
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:282.337
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:0.04
LogP (Chemaxon):2.89

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue