Sodium 4-bromo-3,5-dimethylphenolate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H8BrO.Na
Molecular Weight	223.042
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Sodium 4-bromo-3,5-dimethylphenolate

Structure Search

SMILES

[Na+].CC1=CC([O-])=CC(C)=C1Br

InChI

InChIKey=VEHAUJQLVZROEG-UHFFFAOYSA-M

InChI=1S/C8H9BrO.Na/c1-5-3-7(10)4-6(2)8(5)9;/h3-4,10H,1-2H3;/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula	C8H8BrO
Molecular Weight	200.053
Charge	-1
Count

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

Molecular Formula	Na
Molecular Weight	22.98976928
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 `Wed Apr 02 16:13:59 GMT 2025` Edited by `admin` on `Wed Apr 02 16:13:59 GMT 2025`
Record UNII	VD6UL83LH6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Sodium 4-bromo-3,5-dimethylphenolate

Systematic Name

English

4-Bromo-3,5-dimethylphenol sodium salt

Preferred Name

English

Phenol, 4-bromo-3,5-dimethyl-, sodium salt

Systematic Name

English

Phenol, 4-bromo-3,5-dimethyl-, sodium salt (1:1)

Systematic Name

English

Code System Code Type Description

CAS

865138-37-0

Created by admin on Wed Apr 02 16:13:59 GMT 2025 , Edited by admin on Wed Apr 02 16:13:59 GMT 2025

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PUBCHEM

166177298

Created by admin on Wed Apr 02 16:13:59 GMT 2025 , Edited by admin on Wed Apr 02 16:13:59 GMT 2025

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FDA UNII

VD6UL83LH6

Created by admin on Wed Apr 02 16:13:59 GMT 2025 , Edited by admin on Wed Apr 02 16:13:59 GMT 2025

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Related Record Type Details


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4-Bromo-3,5-dimethylphenol

PARENT -> SALT/SOLVATE

Amount: