Dimethyl 4-iodophthalate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H9IO4
Molecular Weight	320.0805
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Dimethyl 4-iodophthalate

Structure Search

SMILES

COC(=O)C1=CC=C(I)C=C1C(=O)OC

InChI

InChIKey=JVLGGEVUYARXHI-UHFFFAOYSA-N

InChI=1S/C10H9IO4/c1-14-9(12)7-4-3-6(11)5-8(7)10(13)15-2/h3-5H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C10H9IO4
Molecular Weight	320.0805
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 `Sat Dec 16 12:31:11 GMT 2023` Edited by `admin` on `Sat Dec 16 12:31:11 GMT 2023`
Record UNII	GD4CGS6A74
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Dimethyl 4-iodophthalate

Systematic Name

English

1,2-Benzenedicarboxylic acid, 4-iodo-, 1,2-dimethyl ester

Systematic Name

English

1,2-Benzenedicarboxylic acid, 4-iodo-, dimethyl ester

Systematic Name

English

Code System Code Type Description

FDA UNII

GD4CGS6A74

Created by admin on Sat Dec 16 12:31:11 GMT 2023 , Edited by admin on Sat Dec 16 12:31:11 GMT 2023

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ECHA (EC/EINECS)

261-711-1

Created by admin on Sat Dec 16 12:31:11 GMT 2023 , Edited by admin on Sat Dec 16 12:31:11 GMT 2023

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EPA CompTox

DTXSID70208091

Created by admin on Sat Dec 16 12:31:11 GMT 2023 , Edited by admin on Sat Dec 16 12:31:11 GMT 2023

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PUBCHEM

101019

Created by admin on Sat Dec 16 12:31:11 GMT 2023 , Edited by admin on Sat Dec 16 12:31:11 GMT 2023

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CAS

59340-47-5

Created by admin on Sat Dec 16 12:31:11 GMT 2023 , Edited by admin on Sat Dec 16 12:31:11 GMT 2023

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