ISOPHTHALIC ACID

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H6O4
Molecular Weight	166.1308
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOPHTHALIC ACID

Structure Search

SMILES

OC(=O)C1=CC(=CC=C1)C(O)=O

InChI

InChIKey=QQVIHTHCMHWDBS-UHFFFAOYSA-N

InChI=1S/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C8H6O4
Molecular Weight	166.1308
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 `Fri Dec 15 20:15:59 UTC 2023` Edited by `admin` on `Fri Dec 15 20:15:59 UTC 2023`
Record UNII	X35216H9FJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOPHTHALIC ACID

Systematic Name

English

M-CARBOXYBENZOIC ACID

Systematic Name

English

BENZENE-1,3-DICARBOXYLIC ACID

Systematic Name

English

ISOPHTHALIC ACID [HSDB]

Common Name

English

M-PHTHALIC ACID

Common Name

English

3-CARBOXYBENZOIC ACID

Systematic Name

English

NSC-15310

Code

English

ISOTEREPHTHALIC ACID

Common Name

English

ISOPHTHALIC ACID [INCI]

Common Name

English

ISOPHTHALATE

Systematic Name

English

M-BENZENEDICARBOXYLIC ACID

Common Name

English

1,3-BENZENEDICARBOXYLIC ACID

Systematic Name

English

M-DICARBOXYBENZENE

Systematic Name

English

ISOPHTHALIC ACID [MI]

Common Name

English

Classification Tree Code System Code

Food Contact Sustance Notif, (FCN No.)

FCN NO. 211

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

Food Contact Sustance Notif, (FCN No.)

FCN NO, 4

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

Code System Code Type Description

NSC

15310

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

HSDB

2090

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

MERCK INDEX

m6513

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

Merck Index

WIKIPEDIA

ISOPHTHALIC ACID

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

CHEBI

30802

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

ECHA (EC/EINECS)

204-506-4

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

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FDA UNII

X35216H9FJ

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

CAS

121-91-5

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

CHEBI

30803

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

PUBCHEM

8496

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

EPA CompTox

DTXSID3021485

Created by admin on Fri Dec 15 20:15:59 UTC 2023 , Edited by admin on Fri Dec 15 20:15:59 UTC 2023

PRIMARY

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