(Ferrocenylmethyl)trimethylammonium chloride

Catalog Number	ACM83617792-1
CAS	83617-79-2
Synonyms	(Trimethylammoniomethyl)ferrocene chloride
IUPAC Name	cyclopenta-1,3-diene;cyclopenta-1,4-dien-1-ylmethyl(trimethyl)azanium;iron(2+);chloride
Molecular Weight	293.62
Molecular Formula	C14H20ClFeN
Canonical SMILES	C[N+](C)(C)CC1=C[CH-]C=C1.[CH-]1C=CC=C1.[Cl-].[Fe+2]
InChI	InChI=1S/C9H15N.C5H5.ClH.Fe/c1-10(2,3)8-9-6-4-5-7-9;1-2-4-5-3-1;/h4-7H,8H2,1-3H3;1-5H;1H;/q;-1;+2/p-1
InChI Key	IVQIXUCSDNCTDO-UHFFFAOYSA-M
Purity	98%+
Appearance	Light yellow to brown powder to crystal
Storage	Store under inert gas
Complexity	107
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Exact Mass	293.063363
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Monoisotopic Mass	293.063363
Rotatable Bond Count	2
Topological Polar Surface Area	0 Ų