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
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
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
Edited
Sat Dec 16 08:23:10 GMT 2023
by
admin
on
Sat Dec 16 08:23:10 GMT 2023
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Record UNII |
BL2GT05Z2D
|
Record Status |
Validated (UNII)
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Record Version |
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-
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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
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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
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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
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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
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