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Details

Stereochemistry ACHIRAL
Molecular Formula C8H6O5
Molecular Weight 182.1306
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-HYDROXYISOPHTHALIC ACID

SMILES

c1cc(c(cc1C(=O)O)C(=O)O)O

InChI

InChIKey=BCEQKAQCUWUNML-UHFFFAOYSA-N
InChI=1S/C8H6O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H,(H,10,11)(H,12,13)

HIDE SMILES / InChI

Molecular Formula C8H6O5
Molecular Weight 182.1306
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets
PubMed

PubMed

TitleDatePubMed
Poly[bis-(N,N-dimethyl-formamide)(μ-formato)(μ(5)-4-oxidoisophthalato)dizinc(II)].
2009 Jul 25
[Constituents of Gymnadenia conopsea].
2010 Nov
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Jun 26 15:53:25 UTC 2021
Edited
by admin
on Sat Jun 26 15:53:25 UTC 2021
Record UNII
P87FF77O00
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-HYDROXYISOPHTHALIC ACID
MI  
Systematic Name English
4-HYDROXYISOPHTHALIC ACID [MI]
Common Name English
4-HYDROXY-1,3-BENZENEDICARBOXYLIC ACID
Systematic Name English
ISOPHTHALIC ACID, 4-HYDROXY-
Common Name English
SALICYLIC ACID IMPURITY B [EP]
Common Name English
4-HYDROXY-M-PHTHALIC ACID
Common Name English
EUPIRINA
Brand Name English
NSC-2445
Code English
SALICYLIC ACID RELATED COMPOUND B [USP]
Common Name English
SALICYLIC ACID RELATED COMPOUND B [USP-RS]
Common Name English
4-HYDROXYBENZENE-1,3-DICARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
12490
Created by admin on Sat Jun 26 15:53:25 UTC 2021 , Edited by admin on Sat Jun 26 15:53:25 UTC 2021
PRIMARY
CAS
636-46-4
Created by admin on Sat Jun 26 15:53:25 UTC 2021 , Edited by admin on Sat Jun 26 15:53:25 UTC 2021
PRIMARY
ECHA (EC/EINECS)
211-258-0
Created by admin on Sat Jun 26 15:53:25 UTC 2021 , Edited by admin on Sat Jun 26 15:53:25 UTC 2021
PRIMARY
MERCK INDEX
M6136
Created by admin on Sat Jun 26 15:53:25 UTC 2021 , Edited by admin on Sat Jun 26 15:53:25 UTC 2021
PRIMARY Merck Index
USP_CATALOG
1609024
Created by admin on Sat Jun 26 15:53:25 UTC 2021 , Edited by admin on Sat Jun 26 15:53:25 UTC 2021
PRIMARY USP-RS
FDA UNII
P87FF77O00
Created by admin on Sat Jun 26 15:53:25 UTC 2021 , Edited by admin on Sat Jun 26 15:53:25 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
Ph.Eur.; USP
PARENT -> IMPURITY
IDENTIFIED AS IMPURITY B Limits: impurity B: not more than 1.5 times the area of the principal peak in the chromatogram obtained with reference solution (a) (0.15 per cent)