Lead 4-tert-butylbenzoate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	2C11H13O2.Pb
Molecular Weight	561.6
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Lead 4-tert-butylbenzoate

Structure Search

SMILES

[PbH2++].CC(C)(C)C1=CC=C(C=C1)C([O-])=O.CC(C)(C)C2=CC=C(C=C2)C([O-])=O

InChI

InChIKey=DFMBPOGYLUAOQZ-UHFFFAOYSA-L

InChI=1S/2C11H14O2.Pb.2H/c2*1-11(2,3)9-6-4-8(5-7-9)10(12)13;;;/h2*4-7H,1-3H3,(H,12,13);;;/q;;+2;;/p-2

HIDE SMILES / InChI

Molecular Formula	Pb
Molecular Weight	207.2
Charge	2
Count

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

Molecular Formula	C11H13O2
Molecular Weight	177.2197
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 `Sat Dec 16 12:02:35 GMT 2023` Edited by `admin` on `Sat Dec 16 12:02:35 GMT 2023`
Record UNII	SD4HJ5804Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Lead 4-tert-butylbenzoate

Common Name

English

Benzoic acid, 4-(1,1-dimethylethyl)-, lead(2+) salt (2:1)

Systematic Name

English

Lead(2+) 4-(1,1-dimethylethyl)benzoate

Systematic Name

English

Benzoic acid, 4-(1,1-dimethylethyl)-, lead(2+) salt

Common Name

English

Code System Code Type Description

PUBCHEM

44153012

Created by admin on Sat Dec 16 12:02:35 GMT 2023 , Edited by admin on Sat Dec 16 12:02:35 GMT 2023

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CAS

85292-77-9

Created by admin on Sat Dec 16 12:02:35 GMT 2023 , Edited by admin on Sat Dec 16 12:02:35 GMT 2023

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FDA UNII

SD4HJ5804Q

Created by admin on Sat Dec 16 12:02:35 GMT 2023 , Edited by admin on Sat Dec 16 12:02:35 GMT 2023

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ECHA (EC/EINECS)

286-637-7

Created by admin on Sat Dec 16 12:02:35 GMT 2023 , Edited by admin on Sat Dec 16 12:02:35 GMT 2023

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EPA CompTox

DTXSID90234493

Created by admin on Sat Dec 16 12:02:35 GMT 2023 , Edited by admin on Sat Dec 16 12:02:35 GMT 2023

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Related Record Type Details


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4-tert-butylbenzoic acid

PARENT -> SALT/SOLVATE

Amount: