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Ferrocene,[(1S)-1-(dimethylamino)ethyl]-

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Name

Ferrocene,[(1S)-1-(dimethylamino)ethyl]-

EINECS -0
CAS No. 31886-57-4 Density 1.222
PSA 3.24000 LogP 2.36080
Solubility N/A Melting Point N/A
Formula C14H19FeN Boiling Point 95ºC (0.2 torr)
Molecular Weight 257.159 Flash Point >230 °F
Transport Information N/A Appearance dark brown
Safety 26-36 Risk Codes 36/38
Molecular Structure Molecular Structure of 31886-57-4 ((S)-(-)-N,N-DIMETHYL-1-FERROCENYLETHYLAMINE) Hazard Symbols IrritantXi
Synonyms

(S)-(N,N-Dimethyl-1-aminoethyl)ferrocene;(S)-N,N-Dimethyl-1-ferrocenylethylamine;S-[1-(Dimethylamino)ethyl]ferrocene;Ferrocenemethylamine, N,N,a-trimethyl-, (S)-(-)- (8CI);Ferrocene,[1-(dimethylamino)ethyl]-, (S)-;(S)-(-)-N,N-Dimethyl-1-ferrocenylethylamine;(S)-1-Ferrocenyl-N,N-dimethylethylamine;1-cyclopenta-2,4-dienyl-[2-[(1S)-1-dimethylaminoethyl]-1-cyclopenta-2,4-dienyl]iron;

Article Data 38

Ferrocene,[(1S)-1-(dimethylamino)ethyl]- Specification

The Ferrocene,[(1S)-1-(dimethylamino)ethyl]-, with the CAS registry number 31886-57-4, has the systematic name of 1-cyclopenta-2,4-dienyl-[2-[(1S)-1-dimethylaminoethyl]-1-cyclopenta-2,4-dienyl]iron. It belongs to the following product categories: Classes of Metal Compounds; Fe (Iron) Compounds; Ferrocenes; Metallocenes; Transition Metal Compounds. And the molecular formula of the chemical is C14H19FeN.

The characteristics of Ferrocene,[(1S)-1-(dimethylamino)ethyl]- are as followings: (1)#H bond acceptors: 1; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4. 

You should be cautious while dealing with this chemical. It irritates to eyes and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CN(C)[C@@H](C)c2ccc[c-]2[Fe+2][c-]1cccc1
(2)InChI: InChI=1/C9H13N.C5H4.Fe/c1-8(10(2)3)9-6-4-5-7-9;1-2-4-5-3-1;/h4-6,8H,1-3H3;1-4H;/q2*-1;+2/t8-;;/m0../s1/rC14H17FeN/c1-11(16(2)3)13-9-6-10-14(13)15-12-7-4-5-8-12/h4-11H,1-3H3/t11-/m0/s1
(3)InChIKey: RQQMBCSYWAYSGI-QBESQBIKBK

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