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Details

Stereochemistry RACEMIC
Molecular Formula 2C8H15O2.Ba
Molecular Weight 423.734
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BARIUM BIS(2-ETHYLHEXANOATE)

SMILES

[Ba++].CCCCC(CC)C([O-])=O.CCCCC(CC)C([O-])=O

InChI

InChIKey=VJFFDDQGMMQGTQ-UHFFFAOYSA-L
InChI=1S/2C8H16O2.Ba/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula Ba
Molecular Weight 137.327
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C8H15O2
Molecular Weight 143.2035
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 00:14:19 GMT 2023
Edited
by admin
on Sat Dec 16 00:14:19 GMT 2023
Record UNII
QOU5ZV191I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BARIUM BIS(2-ETHYLHEXANOATE)
Systematic Name English
BARIUM DI(2-ETHYLHEXANOATE)
Systematic Name English
2-ETHYLHEXANOIC ACID BARIUM SALT
Systematic Name English
HEXANOIC ACID, 2-ETHYL-, BARIUM SALT
Systematic Name English
HEXANOIC ACID, 2-ETHYL-, BARIUM SALT (2:1)
Systematic Name English
BARIUM 2-ETHYLHEXANOATE
Systematic Name English
BARIUM(II) 2-ETHYLHEXANOATE
Systematic Name English
BARIUM DIETHYLHEXANOATE
Systematic Name English
Code System Code Type Description
FDA UNII
QOU5ZV191I
Created by admin on Sat Dec 16 00:14:19 GMT 2023 , Edited by admin on Sat Dec 16 00:14:19 GMT 2023
PRIMARY
CAS
2457-01-4
Created by admin on Sat Dec 16 00:14:19 GMT 2023 , Edited by admin on Sat Dec 16 00:14:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID8044888
Created by admin on Sat Dec 16 00:14:19 GMT 2023 , Edited by admin on Sat Dec 16 00:14:19 GMT 2023
PRIMARY
ECHA (EC/EINECS)
219-535-8
Created by admin on Sat Dec 16 00:14:19 GMT 2023 , Edited by admin on Sat Dec 16 00:14:19 GMT 2023
PRIMARY
PUBCHEM
102821
Created by admin on Sat Dec 16 00:14:19 GMT 2023 , Edited by admin on Sat Dec 16 00:14:19 GMT 2023
PRIMARY