Chemical ID: 5789135

c1cc2c(cc1S(=O)(=O)[O-])cc(cc2O)S(=O)(=O)[O-]
Chemical ID:
5789135
Name [?]:
4-hydroxynaphthalene-2,7-disulfonate
SMILES [?]:
c1cc2c(cc1S(=O)(=O)[O-])cc(cc2O)S(=O)(=O)[O-]
InChi [?]:
InChI=1/C10H8O7S2/c11-10-5-8(19(15,16)17)4-6-3-7(18(12,13)14)1-2-9(6)10/h1-5,11H,(H,12,13,14)(H,15,16,17)/p-2
InChi Info:
AuxInfo=1/1/N:1,2,5,11,13,4,6,12,3,14,15,8,9,10,17,18,19,7,16/E:(12,13,14)(15,16,17)/CRV:18.6,19.6/rA:19nCCCCCCSOOO-CCCCOSOOO-/rB:s1;d2;s3;d4;d1s5;s6;d7;d7;s7;s4;d11;s12;s3d13;s14;s12;d16;d16;s16;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H6O7S2-2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:-85.9218
Area:442.941
Solvation:-96.9953
Coulombic:34.8418
Bond Count [?]
All:20
Single:11
Double:9
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:302.282
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:-0.07
LogP (Chemaxon):0.37

Name Annotations

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Descriptor Annotations

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