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1291-47-0

Basic Information
CAS No.: 1291-47-0
Name: 1,1'-DIMETHYLFERROCENE
Article Data: 18
Molecular Structure:
Molecular Structure of 1291-47-0 (1,1'-DIMETHYLFERROCENE)
Formula: C12H14Fe
Molecular Weight: 214.09
Synonyms: Iron,bis(methylcyclopentadienyl)- (6CI,7CI);1,1'-Dimethylferrocene;Bis(methylcyclopentadienyl)iron;Dimethylferrocene;
EINECS: 215-067-3
Density: 1.2349 g/cm3(Temp: 35 °C)
Melting Point: 37-40 °C(lit.)
Boiling Point: 70-80 °C(Press: 2 Torr)
Flash Point: 226 °F
Solubility: Slightly soluble in methanol. Insoluble in water.
Appearance: dark orange crystals
PSA: 0.00000
LogP: 2.82070
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Specification

The Ferrocene,1,1'-dimethyl- (8CI,9CI), with CAS registry number 1291-47-0, belongs to the following product categories: (1)Industrial/Fine Chemicals; (2)Classes of Metal Compounds; (3)Fe (Iron) Compounds; (4)Ferrocenes; (5)Metallocenes; (6)Transition Metal Compounds. It has the systematic name of iron(2+) bis(1-methylcyclopenta-2,4-dienide). And the chemical formula of this chemical is C12H14Fe. What's more, its EINECS is 215-067-3.

You can still convert the following datas into molecular structure:
(1)SMILES: C[c-]1cccc1.C[c-]1cccc1.[Fe+2]
(2)InChI: InChI=1/2C6H7.Fe/c2*1-6-4-2-3-5-6;/h2*2-5H,1H3;/q2*-1;+2
(3)InChIKey: YTOVAWUSMUMHIM-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/2C6H7.Fe/c2*1-6-4-2-3-5-6;/h2*2-5H,1H3;/q2*-1;+2
(5)Std. InChIKey: YTOVAWUSMUMHIM-UHFFFAOYSA-N