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

Details

Stereochemistry RACEMIC
Molecular Formula C6H7N.2C3H5O3.Cd
Molecular Weight 383.677
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANILINOCADMIUM DILACTATE

SMILES

[Cd++].CC(O)C([O-])=O.CC(O)C([O-])=O.NC1=CC=CC=C1

InChI

InChIKey=PNQRFKRVXIFPRM-UHFFFAOYSA-L
InChI=1S/C6H7N.2C3H6O3.Cd/c7-6-4-2-1-3-5-6;2*1-2(4)3(5)6;/h1-5H,7H2;2*2,4H,1H3,(H,5,6);/q;;;+2/p-2

HIDE SMILES / InChI

Molecular Formula C3H5O3
Molecular Weight 89.07
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula Cd
Molecular Weight 112.411
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H7N
Molecular Weight 93.1265
Charge 0
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 08:23:10 GMT 2023
Edited
by admin
on Sat Dec 16 08:23:10 GMT 2023
Record UNII
BL2GT05Z2D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANILINOCADMIUM DILACTATE
Systematic Name English
CADMIUM, (BENZENAMINE)BIS(2-HYDROXYPROPANOATO)-
Common Name English
PURATURF 177
Brand Name English
LACTIC ACID, CADMIUM SALT, COMPD. WITH ANILINE (1:1)
Systematic Name English
PHENYLAMINO CADMIUM DILACTATE
Systematic Name English
CADMIUM, (BENZENAMINE)BIS(2-HYDROXYPROPANOATO-O1,O2)-
Common Name English
Code System Code Type Description
FDA UNII
BL2GT05Z2D
Created by admin on Sat Dec 16 08:23:10 GMT 2023 , Edited by admin on Sat Dec 16 08:23:10 GMT 2023
PRIMARY
CAS
19651-91-3
Created by admin on Sat Dec 16 08:23:10 GMT 2023 , Edited by admin on Sat Dec 16 08:23:10 GMT 2023
PRIMARY
EPA CompTox
DTXSID70894973
Created by admin on Sat Dec 16 08:23:10 GMT 2023 , Edited by admin on Sat Dec 16 08:23:10 GMT 2023
PRIMARY
PUBCHEM
44146448
Created by admin on Sat Dec 16 08:23:10 GMT 2023 , Edited by admin on Sat Dec 16 08:23:10 GMT 2023
PRIMARY