(Aminomethyl)ferrocene

Catalog Number	ACM12176384
CAS	12176-38-4
Synonyms	Ferrocene,(aminomethyl)-
Molecular Weight	215.07
Molecular Formula	C11H13FeN
Canonical SMILES	C1=C[CH]C=C1.C1=C[CH]C(=C1)CN.[Fe]
InChI	InChI=1S/C6H8N.C5H5.Fe/c7-5-6-3-1-2-4-6;1-2-4-5-3-1;/h1-4H,5,7H2;1-5H;
InChI Key	WUCQEPSSJGFPKW-UHFFFAOYSA-N
Melting Point	108-110 °C
Purity	98%
Complexity	137
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Exact Mass	215.039735
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Monoisotopic Mass	215.039735
Rotatable Bond Count	1
Topological Polar Surface Area	26 Ų