ALTERNATIVE DEFINITION for [BROMCRESOL PURPLE SODIUM]

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H18Br2O6S.Na
Molecular Weight	581.227
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure of ALTERNATIVE DEFINITION for [BROMCRESOL PURPLE SODIUM]

Structure Search

SMILES

[Na+].CC1=C(O)C(Br)=CC(=C1)C(O)(C2=CC(C)=C(O)C(Br)=C2)C3=CC=CC=C3S(O)(=O)=O

InChI

InChIKey=VAZMLZVDOFMYGK-UHFFFAOYSA-N

InChI=1S/C21H18Br2O6S.Na/c1-11-7-13(9-16(22)19(11)24)21(26,14-8-12(2)20(25)17(23)10-14)15-5-3-4-6-18(15)30(27,28)29;/h3-10,24-26H,1-2H3,(H,27,28,29);/q;+1

HIDE SMILES / InChI

Molecular Formula	C21H17Br2O6S
Molecular Weight	557.229
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 05:30:31 GMT 2025` Edited by `admin` on `Wed Apr 02 05:30:31 GMT 2025`
Record UNII	F9HZ0OW9HE
Record Status	`alternative`
Record Version

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BROMCRESOL PURPLE SODIUM

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BROMCRESOL PURPLE SODIUM

Primary Definition