BROMOCRESOL GREEN SODIUM

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H13Br4O5S.Na
Molecular Weight	719.996
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].CC1=C(Br)C(O)=C(Br)C=C1\C(C2=CC=CC=C2S([O-])(=O)=O)=C3/C=C(Br)C(=O)C(Br)=C3C

InChI

InChIKey=PZBRPDUUWGYUTE-IWSIBTJSSA-M

InChI=1S/C21H14Br4O5S.Na/c1-9-12(7-14(22)20(26)18(9)24)17(11-5-3-4-6-16(11)31(28,29)30)13-8-15(23)21(27)19(25)10(13)2;/h3-8,26H,1-2H3,(H,28,29,30);/q;+1/p-1/b17-13+;

HIDE SMILES / InChI

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

Molecular Formula	C21H13Br4O5S
Molecular Weight	697.006
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:24:25 GMT 2025` Edited by `admin` on `Mon Mar 31 23:24:25 GMT 2025`
Record UNII	UJO20XQ651
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BROMOCRESOL GREEN SODIUM

Common Name

English

BROMCRESOL GREEN SODIUM SALT [MI]

Preferred Name

English

BROMOCRESOL GREEN SODIUM SALT

Common Name

English

PHENOL, 4,4'-(1,1-DIOXIDO-3H-2,1-BENZOXATHIOL-3-YLIDENE)BIS(2,6-DIBROMO-3-METHYL-, SODIUM SALT (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

23690256