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54053-42-8

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Basic Information
CAS No.: 54053-42-8
Name: (S)-(-)-N,N-Dimethyl-1-ferrocenylethylamine
Molecular Structure:
Molecular Structure of 54053-42-8 ((S)-(-)-N,N-Dimethyl-1-ferrocenylethylamine)
Formula: C14H19FeN
Molecular Weight: 257.15
Synonyms: Ferrocene, [(1S)-1-(dimethylamino)ethyl]-;
Density: 1.222 g/mL at 20 °C(lit.)
Boiling Point: 120-121 °C 0.7 mm Hg(lit.)
Flash Point: >230 °F
Appearance: dark brown
Hazard Symbols: IrritantXi
Risk Codes: 36/38
Safety: 26-36
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Specification

The (S)-(-)-N,N-Dimethyl-1-ferrocenylethylamine, also known as Ferrocene, [(1S)-1-(dimethylamino)ethyl]-, is an organic compound with the formula C14H19FeN. With the CAS registry number 54053-42-8, its systematic name is cyclopenta-2,4-dien-1-yl-[2-[(1S)-1-(dimethylamino)ethyl]cyclopenta-2,4-dien-1-yl]iron.

Physical properties of (S)-(-)-N,N-Dimethyl-1-ferrocenylethylamine: (1)#H bond acceptors: 1; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 3.24 Å2.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: C[C@@H](C1=CC=CC1[Fe]C2C=CC=C2)N(C)C
(2)InChI: InChI=1/C9H14N.C5H5.Fe/c1-8(10(2)3)9-6-4-5-7-9;1-2-4-5-3-1;/h4-8H,1-3H3;1-5H;/t8-;;/m0../s1/rC14H19FeN/c1-11(16(2)3)13-9-6-10-14(13)15-12-7-4-5-8-12/h4-12,14H,1-3H3/t11-,14?/m0/s1
(3)InChIKey: ISOLNZQTVMCEOI-LKAAWJLEBY