DIBUTYL ISOPHTHALATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H22O4
Molecular Weight	278.3435
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIBUTYL ISOPHTHALATE

Structure Search

SMILES

CCCCOC(=O)C1=CC(=CC=C1)C(=O)OCCCC

InChI

InChIKey=GOPWOUQJIMLDDM-UHFFFAOYSA-N

InChI=1S/C16H22O4/c1-3-5-10-19-15(17)13-8-7-9-14(12-13)16(18)20-11-6-4-2/h7-9,12H,3-6,10-11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C16H22O4
Molecular Weight	278.3435
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 22:13:55 GMT 2025` Edited by `admin` on `Mon Mar 31 22:13:55 GMT 2025`
Record UNII	9JXO0GKJ2Y
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-6348

Preferred Name

English

DIBUTYL ISOPHTHALATE

Systematic Name

English

Code System Code Type Description

CAS

3126-90-7

Created by admin on Mon Mar 31 22:13:55 GMT 2025 , Edited by admin on Mon Mar 31 22:13:55 GMT 2025

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NSC

6348

Created by admin on Mon Mar 31 22:13:55 GMT 2025 , Edited by admin on Mon Mar 31 22:13:55 GMT 2025

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FDA UNII

9JXO0GKJ2Y

Created by admin on Mon Mar 31 22:13:55 GMT 2025 , Edited by admin on Mon Mar 31 22:13:55 GMT 2025

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EPA CompTox

DTXSID8021696

Created by admin on Mon Mar 31 22:13:55 GMT 2025 , Edited by admin on Mon Mar 31 22:13:55 GMT 2025

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PUBCHEM

18405

Created by admin on Mon Mar 31 22:13:55 GMT 2025 , Edited by admin on Mon Mar 31 22:13:55 GMT 2025

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