U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C22H22N3O.3Cl.Zn
Molecular Weight 516.198
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BASIC BLUE 75

SMILES

[Cl-].[Cl-].[Cl-].[Zn++].CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(NC4=CC=CC=C4)=CC3=[O+]2

InChI

InChIKey=MOVFQCRDTSTHCH-UHFFFAOYSA-K
InChI=1S/C22H22N3O.3ClH.Zn/c1-3-25(4-2)18-11-13-20-22(15-18)26-21-14-17(10-12-19(21)24-20)23-16-8-6-5-7-9-16;;;;/h5-15,23H,3-4H2,1-2H3;3*1H;/q+1;;;;+2/p-3

HIDE SMILES / InChI

Molecular Formula C22H22N3O
Molecular Weight 344.4296
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Zn
Molecular Weight 65.409
Charge 2
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 01:55:20 GMT 2023
Edited
by admin
on Sat Dec 16 01:55:20 GMT 2023
Record UNII
H84HHH838R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BASIC BLUE 75
INCI  
INCI  
Official Name English
PHENOXAZIN-5-IUM, 3-(DIETHYLAMINO)-7-(PHENYLAMINO)-, TRICHLOROZINCATE(1-)
Common Name English
AHC BLUE SP
Brand Name English
BASIC BLUE 75 [INCI]
Common Name English
ZINCATE(1-), TRICHLORO-, 3-(DIETHYLAMINO)-7-(PHENYLAMINO)PHENOXAZIN-5-IUM
Common Name English
PHENOXAZIN-5-IUM, 3-(DIETHYLAMINO)-7-(PHENYLAMINO)-, TRICHLOROZINCATE(1-) (1:1)
Common Name English
Code System Code Type Description
PUBCHEM
44153362
Created by admin on Sat Dec 16 01:55:20 GMT 2023 , Edited by admin on Sat Dec 16 01:55:20 GMT 2023
PRIMARY
FDA UNII
H84HHH838R
Created by admin on Sat Dec 16 01:55:20 GMT 2023 , Edited by admin on Sat Dec 16 01:55:20 GMT 2023
PRIMARY
CAS
73398-25-1
Created by admin on Sat Dec 16 01:55:20 GMT 2023 , Edited by admin on Sat Dec 16 01:55:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
277-426-0
Created by admin on Sat Dec 16 01:55:20 GMT 2023 , Edited by admin on Sat Dec 16 01:55:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID80994110
Created by admin on Sat Dec 16 01:55:20 GMT 2023 , Edited by admin on Sat Dec 16 01:55:20 GMT 2023
PRIMARY