3,5-Diamino-2,4,6-triiodobenzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H5I3N2O2
Molecular Weight	529.8402
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-Diamino-2,4,6-triiodobenzoic acid

Structure Search

SMILES

NC1=C(I)C(C(O)=O)=C(I)C(N)=C1I

InChI

InChIKey=GOQCZMZLABPEME-UHFFFAOYSA-N

InChI=1S/C7H5I3N2O2/c8-2-1(7(13)14)3(9)6(12)4(10)5(2)11/h11-12H2,(H,13,14)

HIDE SMILES / InChI

Molecular Formula	C7H5I3N2O2
Molecular Weight	529.8402
Charge	0
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 23:23:22 GMT 2025` Edited by `admin` on `Mon Mar 31 23:23:22 GMT 2025`
Record UNII	9CR2L6ACC3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Benzoic acid, 3,5-diamino-2,4,6-triiodo-

Preferred Name

English

3,5-Diamino-2,4,6-triiodobenzoic acid

Systematic Name

English

Code System Code Type Description

FDA UNII

9CR2L6ACC3

Created by admin on Mon Mar 31 23:23:22 GMT 2025 , Edited by admin on Mon Mar 31 23:23:22 GMT 2025

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EPA CompTox

DTXSID20203596

Created by admin on Mon Mar 31 23:23:22 GMT 2025 , Edited by admin on Mon Mar 31 23:23:22 GMT 2025

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CAS

5505-16-8

Created by admin on Mon Mar 31 23:23:22 GMT 2025 , Edited by admin on Mon Mar 31 23:23:22 GMT 2025

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PUBCHEM

21680

Created by admin on Mon Mar 31 23:23:22 GMT 2025 , Edited by admin on Mon Mar 31 23:23:22 GMT 2025

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ECHA (EC/EINECS)

226-845-7

Created by admin on Mon Mar 31 23:23:22 GMT 2025 , Edited by admin on Mon Mar 31 23:23:22 GMT 2025

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