Details
Stereochemistry | RACEMIC |
Molecular Formula | 2C3H5O3.Ca.H2O |
Molecular Weight | 236.233 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[Ca++].CC(O)C([O-])=O.CC(O)C([O-])=O
InChI
InChIKey=MDAVASCOAJMZHZ-UHFFFAOYSA-L
InChI=1S/2C3H6O3.Ca.H2O/c2*1-2(4)3(5)6;;/h2*2,4H,1H3,(H,5,6);;1H2/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 | H2O |
Molecular Weight | 18.0153 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | Ca |
Molecular Weight | 40.078 |
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
Edited
Sat Dec 16 00:43:57 UTC 2023
by
admin
on
Sat Dec 16 00:43:57 UTC 2023
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Record UNII |
679364496I
|
Record Status |
Validated (UNII)
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Record Version |
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-
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100000134149
Created by
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679364496I
Created by
admin on Sat Dec 16 00:43:57 UTC 2023 , Edited by admin on Sat Dec 16 00:43:57 UTC 2023
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SUB59793
Created by
admin on Sat Dec 16 00:43:57 UTC 2023 , Edited by admin on Sat Dec 16 00:43:57 UTC 2023
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5282393
Created by
admin on Sat Dec 16 00:43:57 UTC 2023 , Edited by admin on Sat Dec 16 00:43:57 UTC 2023
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69843-88-5
Created by
admin on Sat Dec 16 00:43:57 UTC 2023 , Edited by admin on Sat Dec 16 00:43:57 UTC 2023
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Related Record | Type | Details | ||
---|---|---|---|---|
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ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |