Octylbutyrate

Catalog Number	ACM85959837-1
CAS	85959-83-7
Structure
Synonyms	Decamethylhafnocene dichloride
Molecular Weight	519.8
Molecular Formula	C20H30Cl2Hf
Canonical SMILES	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Cl-].[Cl-].[Hf+4]
InChI	InChI=1S/2C10H15.2ClH.Hf/c2*1-7-6-10(4,5)9(3)8(7)2;/h2*1-5H3;2*1H;/q2*-1;+4/p-2
InChI Key	YPRLSLCBPOTFGE-UHFFFAOYSA-L
Melting Point	>300 °C
Purity	98%
Appearance	Crystal
Exact Mass	520.11902
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Monoisotopic Mass	520.11902
Rotatable Bond Count	0
Topological Polar Surface Area	0 Ų