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10196-66-4 | Tetradecanoic acid, barium salt (2:1)
CAS No: 10196-66-4 Catalog No: AG00063D MDL No:
Product Description
Catalog Number:
AG00063D
Chemical Name:
Tetradecanoic acid, barium salt (2:1)
CAS Number:
10196-66-4
Molecular Formula:
C28H54BaO4
Molecular Weight:
592.0530
IUPAC Name:
barium(2+);tetradecanoate
InChI:
InChI=1S/2C14H28O2.Ba/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16;/h2*2-13H2,1H3,(H,15,16);/q;;+2/p-2
InChI Key:
JLDBJDNKYFLMHI-UHFFFAOYSA-L
SMILES:
CCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCC(=O)[O-].[Ba+2]
EC Number:
233-488-0
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
592.307g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
592.063g/mol
Monoisotopic Mass:
592.307g/mol
Rotatable Bond Count:
22
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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