Registration Dossier

Data platform availability banner - registered substances factsheets

Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Currently viewing:
IUPAC name:
calcium diacetate

Inventory

EC number:
200-540-9
EC name:
Calcium di(acetate)
CAS number:
62-54-4
CAS number:
62-54-4
Synonyms
Names:
Acetic acid, calcium salt
Calcium acetate
Identifier:
IUPAC name
Calcium di(acetate)
Identifier:
IUPAC name
Calcium diacetate
Identifier:
IUPAC name
calcium di(acetate)
Identifier:
other: Molecular formula
C2H3O2.1/2Ca
Identifier:
other: SMILES notation
CC(=O)[O-].CC(=O)[O-].[Ca+2]
Identifier:
other: InChl
InChI=1S/2C2H4O2/c2*1-2(3)4/h2*1H3,(H,3,4)/p-2
Identifier:
other: SMILES notation
O=C(C)[O-].O=C(C)[O-].[Ca][Ca+]
Identifier:
other: SMILES notation
[Ca](OC(=O)C)OC(=O)C
calcium diacetate

Molecular and structural information

Molecular formula:
C2H4O2.1/2Ca
Molecular weight:
158.166
SMILES notation:
[Ca+2].CC(=O)[O-].CC(=O)[O-]
InChl:
InChI=1/2C2H4O2.Ca/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2
Structural formula:
Chemical structure

Related substances