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Ethyl hydrogen sulphate, calcium salt

HCID 71589
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Basic information

CAS
926-03-4
Standard SMILES
CCOS(=O)(=O)[O-].CCOS(=O)(=O)[O-].[Ca+2]
InChIKey
AWSAYQTWGIFWBG-UHFFFAOYSA-L
Molecular formula
C4H10CaO8S2
Average molar mass
290.3 g/mol
Monoisotopic mass
289.9443005

Names & identifiers

Preferred name
Ethyl hydrogen sulphate, calcium salt
IUPAC
calcium ethyl sulfate
English name
CALCIUM ETHYLSULFATE
Molecular formula
C4H10CaO8S2
Molecular weight
290.33

Names & synonyms

926-03-4EINECS 213-131-5Ethyl hydrogen sulphate, calcium saltcalcium bis(ethyl sulfate)SCHEMBL26929124DTXSID20919069AWSAYQTWGIFWBG-UHFFFAOYSA-LCALCIUM ETHYLSULFATEBis[(ethylsulfo)oxy]calciumSulfuric acid monoethyl ester calcium salt

Database identifiers

CAS
926-03-4
PubChem CID
71589
DTXSID
DTXSID20919069
EC Number
213-131-5
Nikkaji
J298.491A

Properties

Computed structural properties

Topological polar surface area
150 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
104

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