U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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
Structure of CALCIUM ETHYL ACETYLACETONATE

SMILES

[Ca++].CCOC(=O)[CH-]C(C)=O.CCOC(=O)[CH-]C(C)=O

InChI

InChIKey=COXVJMZQJCOELX-UHFFFAOYSA-N
InChI=1S/2C6H9O3.Ca/c2*1-3-9-6(8)4-5(2)7;/h2*4H,3H2,1-2H3;/q2*-1;+2

HIDE SMILES / InChI

Molecular Formula C6H10O3
Molecular Weight 130.1418
Charge 0
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 Sat Dec 16 08:40:06 GMT 2023
Edited
by admin
on Sat Dec 16 08:40:06 GMT 2023
Record UNII
05DZX5842X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALCIUM ETHYL ACETYLACETONATE
Common Name English
ETHYL CALCIOACETOACETATE
Systematic Name English
BUTANOIC ACID, 3-OXO-, ETHYL ESTER, ION(1-), CALCIUM
Systematic Name English
ETHYL ACETOACETATE CALCIUM SALT
Common Name English
ACETOACETIC ACID, ETHYL ESTER, CALCIUM COMPLEX (2:1)
Common Name English
CALCIUM, BIS(ETHYL-3-OXOBUTANOATO-O(SUP 1),O(SUP 3)-, (T-4)-
Systematic Name English
CALCIUM ETHYL ACETOACETATE
Systematic Name English
CALCIUM, BIS(HYDROGEN ACETOACETATO)-, DIETHYL ESTER
Common Name English
BIS(ETHYL ACETOACETATO)CALCIUM
Common Name English
CALCIUM BIS(2-ETHOXYCARBONYL-1-METHYLVINYL OXIDE)
Common Name English
Code System Code Type Description
FDA UNII
05DZX5842X
Created by admin on Sat Dec 16 08:40:06 GMT 2023 , Edited by admin on Sat Dec 16 08:40:06 GMT 2023
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CAS
16715-59-6
Created by admin on Sat Dec 16 08:40:06 GMT 2023 , Edited by admin on Sat Dec 16 08:40:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID601337713
Created by admin on Sat Dec 16 08:40:06 GMT 2023 , Edited by admin on Sat Dec 16 08:40:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
240-769-1
Created by admin on Sat Dec 16 08:40:06 GMT 2023 , Edited by admin on Sat Dec 16 08:40:06 GMT 2023
PRIMARY
PUBCHEM
12247257
Created by admin on Sat Dec 16 08:40:06 GMT 2023 , Edited by admin on Sat Dec 16 08:40:06 GMT 2023
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