Copper dibutyl diphthalate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	2C12H13O4.Cu
Molecular Weight	506.004
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Copper dibutyl diphthalate

Structure Search

SMILES

[Cu++].CCCCOC(=O)C1=CC=CC=C1C([O-])=O.CCCCOC(=O)C2=C(C=CC=C2)C([O-])=O

InChI

InChIKey=FQHSBEXCSPGVGY-UHFFFAOYSA-L

InChI=1S/2C12H14O4.Cu/c2*1-2-3-8-16-12(15)10-7-5-4-6-9(10)11(13)14;/h2*4-7H,2-3,8H2,1H3,(H,13,14);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula	Cu
Molecular Weight	63.546
Charge	2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C12H13O4
Molecular Weight	221.2292
Charge	-1
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 `Tue Apr 01 20:03:50 GMT 2025` Edited by `admin` on `Tue Apr 01 20:03:50 GMT 2025`
Record UNII	YM4YSA3UQB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Copper dibutyl diphthalate

Common Name

English

NSC-231385

Preferred Name

English

1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1)

Common Name

English

Copper(II) monobutyl phthalate

Common Name

English

Copper(2+) monobutyl phthalate

Common Name

English

1,2-Benzenedicarboxylic acid, monobutyl ester, copper(2+) salt

Common Name

English

Code System Code Type Description

PUBCHEM

79467

Created by admin on Tue Apr 01 20:03:50 GMT 2025 , Edited by admin on Tue Apr 01 20:03:50 GMT 2025

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CAS

5423-38-1

Created by admin on Tue Apr 01 20:03:50 GMT 2025 , Edited by admin on Tue Apr 01 20:03:50 GMT 2025

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NSC

231385

Created by admin on Tue Apr 01 20:03:50 GMT 2025 , Edited by admin on Tue Apr 01 20:03:50 GMT 2025

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EPA CompTox

DTXSID40969208

Created by admin on Tue Apr 01 20:03:50 GMT 2025 , Edited by admin on Tue Apr 01 20:03:50 GMT 2025

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ECHA (EC/EINECS)

226-554-5

Created by admin on Tue Apr 01 20:03:50 GMT 2025 , Edited by admin on Tue Apr 01 20:03:50 GMT 2025

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FDA UNII

YM4YSA3UQB

Created by admin on Tue Apr 01 20:03:50 GMT 2025 , Edited by admin on Tue Apr 01 20:03:50 GMT 2025

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Amount: