Valproate bismuth

Catalog Number	ACM94071097-1
CAS	94071-09-7
Structure
Synonyms	Bismuth 2-propylvalerate
Molecular Weight	638.6
Molecular Formula	C24H45BiO6
Canonical SMILES	CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].[Bi+3]
InChI	InChI=1S/3C8H16O2.Bi/c3*1-3-5-7(6-4-2)8(9)10;/h3*7H,3-6H2,1-2H3,(H,9,10);/q;+3/p-3
InChI Key	YZDVVHSLIPLZLO-UHFFFAOYSA-K
Exact Mass	638.30201
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Monoisotopic Mass	638.30201
Rotatable Bond Count	12
Topological Polar Surface Area	120 Ų