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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

IUPAC name:
Calcium carbonate

Inventory

EC number:
221-621-5
EC name:
Calcium tartrate
CAS number:
3164-34-9
CAS number:
3164-34-9
Synonyms
Names:
2,3-Dihydroxybutanedioic acid, calcium salt Butanedioic acid, 2,3-dihydroxy-, calcium salt Calcium tartarate Calcium tartrate Tartaric acid, calcium salt
Butanedioic acid, 2,3-dihydroxy- (2R,3R)-, calcium salt (1:1)
Butanedioic acid, 2,3-dihydroxy- (2R,3R)-,calcium salt (1:1)
Butanedioic acid, 2,3-dihydroxy- [R-(R*,R*)]-, calcium salt (1:1)
Butanedioic acid, 2,3-dihydroxy- [R-(R*,R*)]-,calcium salt (1:1)
Calcium tartrate
Calciumtartrat
Tartrate de calcium
Tartrato cálcico
Tartrato de calcio
Identifier:
IUPAC name
calcium 2,3-dihydroxybutanedioate
Identifier:
IUPAC name
calcium tartarate
Identifier:
IUPAC name
calcium tartrate
Identifier:
other: SMILES notation
[Ca+2].OC(C(O)C(=O)[O-])C(=O)[O-]
Identifier:
other: SMILES notation
Ca+2].O[C@H]([C@@H](O)C(O)=O)C(O)=O
Identifier:
other: InChl
InChI=1/C4H6O6.Ca/c5-1(3(7)8)2(6)4(9)10;/h1-2,5-6H,(H,7,8)(H,9,10);/q;+2/p-2
Identifier:
other: InChl
InChI=1/C4H6O6.Ca/c5-1(3(7)8)2(6)4(9)10;/h1-2,5-6H,(H,7,8)(H,9,10);/q;+2/p-2
Identifier:
other: InChl
InChI=1/C4H6O6.Ca/c5-1(3(7)8)2(6)4(9)10;/h1-2,5-6H,(H,7,8)(H,9,10);/q;+2/t1-,2-;/m1./s1
Identifier:
other: SMILES notation
[Ca+2].O=C([O-])C(O)C(O)C([O-])=O
Identifier:
other: SMILES notation
[Ca+2].OC(C(O)C(=O)[O-])C(=O)[O-]
2,3-Dihydroxybutanedioic acid calcium salt

Molecular and structural information

Molecular formula:
C4H6O6.Ca
Molecular weight:
188.15
SMILES notation:
[Ca+2].O=C([O-])C(O)C(O)C([O-])=O
InChl:
1/C4H6O6.Ca/c5-1(3(7)8)2(6)4(9)10;/h1-2,5-6H,(H,7,8)(H,9,10);/q;+2/p-2
Structural formula:
Chemical structure

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