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Details

Stereochemistry ACHIRAL
Molecular Formula 2C17H11N2O6S.Sr
Molecular Weight 830.31
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of PIGMENT ORANGE 79

SMILES

[Sr++].OC(=O)C1=CC=C(C=C1)\N=N\C2=C3C=CC(=CC3=CC=C2O)S([O-])(=O)=O.OC(=O)C4=CC=C(C=C4)\N=N\C5=C6C=CC(=CC6=CC=C5O)S([O-])(=O)=O

InChI

InChIKey=SSMSZSIFKGCIHN-VFUQPONKSA-L
InChI=1S/2C17H12N2O6S.Sr/c2*20-15-8-3-11-9-13(26(23,24)25)6-7-14(11)16(15)19-18-12-4-1-10(2-5-12)17(21)22;/h2*1-9,20H,(H,21,22)(H,23,24,25);/q;;+2/p-2/b2*19-18+;

HIDE SMILES / InChI

Molecular Formula C17H11N2O6S
Molecular Weight 371.344
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula Sr
Molecular Weight 87.62
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:29:47 GMT 2025
Edited
by admin
on Mon Mar 31 23:29:47 GMT 2025
Record UNII
J7PSW6L868
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOIC ACID, 4-((2-HYDROXY-6-SULFO-1-NAPHTHALENYL)AZO)-, STRONTIUM SALT (2:1)
Preferred Name English
PIGMENT ORANGE 79
Common Name English
BENZOIC ACID, 4-(2-(2-HYDROXY-6-SULFO-1-NAPHTHALENYL)DIAZENYL)-, STRONTIUM SALT (2:1)
Common Name English
C.I. PIGMENT ORANGE 79
Common Name English
Classification Tree Code System Code
Food Contact Sustance Notif, (FCN No.) FCN NO. 27
Created by admin on Mon Mar 31 23:29:47 GMT 2025 , Edited by admin on Mon Mar 31 23:29:47 GMT 2025
Code System Code Type Description
EPA CompTox
DTXSID801036169
Created by admin on Mon Mar 31 23:29:47 GMT 2025 , Edited by admin on Mon Mar 31 23:29:47 GMT 2025
PRIMARY
FDA UNII
J7PSW6L868
Created by admin on Mon Mar 31 23:29:47 GMT 2025 , Edited by admin on Mon Mar 31 23:29:47 GMT 2025
PRIMARY
CAS
250640-08-5
Created by admin on Mon Mar 31 23:29:47 GMT 2025 , Edited by admin on Mon Mar 31 23:29:47 GMT 2025
PRIMARY
PUBCHEM
15869230
Created by admin on Mon Mar 31 23:29:47 GMT 2025 , Edited by admin on Mon Mar 31 23:29:47 GMT 2025
PRIMARY
CAS
945426-62-0
Created by admin on Mon Mar 31 23:29:47 GMT 2025 , Edited by admin on Mon Mar 31 23:29:47 GMT 2025
ALTERNATIVE