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Details

Stereochemistry ACHIRAL
Molecular Formula 2C2Cl3O2.Ca
Molecular Weight 364.836
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM TRICHLOROACETATE

SMILES

[Ca++].[O-]C(=O)C(Cl)(Cl)Cl.[O-]C(=O)C(Cl)(Cl)Cl

InChI

InChIKey=PAFYVDNYOJAWDX-UHFFFAOYSA-L
InChI=1S/2C2HCl3O2.Ca/c2*3-2(4,5)1(6)7;/h2*(H,6,7);/q;;+2/p-2

HIDE SMILES / InChI

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

Molecular Formula C2Cl3O2
Molecular Weight 162.379
Charge -1
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 Sat Dec 16 09:37:08 GMT 2023
Edited
by admin
on Sat Dec 16 09:37:08 GMT 2023
Record UNII
491SS42JXK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALCIUM TRICHLOROACETATE
Systematic Name English
ACETIC ACID, TRICHLORO-, CALCIUM SALT
Systematic Name English
ACETIC ACID, 2,2,2-TRICHLORO-, CALCIUM SALT (2:1)
Systematic Name English
TCA-CALCIUM
ISO  
Common Name English
TCA-CALCIUM [ISO]
Common Name English
Code System Code Type Description
CAS
21348-16-3
Created by admin on Sat Dec 16 09:37:08 GMT 2023 , Edited by admin on Sat Dec 16 09:37:08 GMT 2023
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PUBCHEM
88874
Created by admin on Sat Dec 16 09:37:08 GMT 2023 , Edited by admin on Sat Dec 16 09:37:08 GMT 2023
PRIMARY
ALANWOOD
TCA-calcium
Created by admin on Sat Dec 16 09:37:08 GMT 2023 , Edited by admin on Sat Dec 16 09:37:08 GMT 2023
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FDA UNII
491SS42JXK
Created by admin on Sat Dec 16 09:37:08 GMT 2023 , Edited by admin on Sat Dec 16 09:37:08 GMT 2023
PRIMARY
ECHA (EC/EINECS)
244-339-4
Created by admin on Sat Dec 16 09:37:08 GMT 2023 , Edited by admin on Sat Dec 16 09:37:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID50175616
Created by admin on Sat Dec 16 09:37:08 GMT 2023 , Edited by admin on Sat Dec 16 09:37:08 GMT 2023
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