Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | 2C6H9O3.Ca |
| Molecular Weight | 298.346 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CC(C)CC(=O)C([O-])=O.CC(C)CC(=O)C([O-])=O
InChI
InChIKey=WQZNGJIBHXYVNW-UHFFFAOYSA-L
InChI=1S/2C6H10O3.Ca/c2*1-4(2)3-5(7)6(8)9;/h2*4H,3H2,1-2H3,(H,8,9);/q;;+2/p-2
| Molecular Formula | C6H9O3 |
| Molecular Weight | 129.1339 |
| Charge | -1 |
| 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 18:32:54 UTC 2023
by
admin
on
Sat Dec 16 18:32:54 UTC 2023
|
| Record UNII |
5L325UH89S
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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257-457-6
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admin on Sat Dec 16 18:32:54 UTC 2023 , Edited by admin on Sat Dec 16 18:32:54 UTC 2023
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5L325UH89S
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DTXSID20966159
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100000088178
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51828-95-6
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admin on Sat Dec 16 18:32:54 UTC 2023 , Edited by admin on Sat Dec 16 18:32:54 UTC 2023
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4160734
Created by
admin on Sat Dec 16 18:32:54 UTC 2023 , Edited by admin on Sat Dec 16 18:32:54 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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SOLVATE->ANHYDROUS |
