Structure

056-(Ferrocenyl)hexanethiol

CAS
134029-92-8
Catalog Number
ACM134029928
Category
Biomaterials
Molecular Weight
302.261
Molecular Formula
C11H17S.C5H5.Fe

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Specification

Synonyms
056-(FERROCENYL)HEXANETHIOL;6-(Ferrocenyl)hexanethiol;6-(Mercaptohexyl)ferrocene;6-(Ferrocenyl)hexanethiol,6-(Mercaptohexyl)ferrocene;FERROCENYL)HEXANETHIOL;FHT
IUPAC Name
056-(FERROCENYL)HEXANETHIOL
Boiling Point
321-353ºC
Exact Mass
302.07900
Hazard Statements
Xi
Safety Description
26
What is the molecular formula of (056-(Ferrocenyl)hexanethiol)?

The molecular formula is C16H22FeS.

What are the synonyms for (056-(Ferrocenyl)hexanethiol)?

The synonyms are 6-(Mercaptohexyl)ferrocene, MFCD09265168, AKOS025294325, and FT-0699376.

What is the molecular weight of (056-(Ferrocenyl)hexanethiol)?

The molecular weight is 302.3 g/mol.

What are the component compounds of (056-(Ferrocenyl)hexanethiol)?

The component compounds are (Cyclopentadienyl), (CID 16218379), and (Iron).

What is the InChI for (056-(Ferrocenyl)hexanethiol)?

The InChI is InChI=1S/C11H17S.C5H5.Fe/c12-10-6-2-1-3-7-11-8-4-5-9-11;1-2-4-5-3-1;/h4-5,8-9,12H,1-3,6-7,10H2;1-5H.

What is the InChIKey for (056-(Ferrocenyl)hexanethiol)?

The InChIKey is YENJERDZPAXYRX-UHFFFAOYSA-N.

What is the canonical SMILES for (056-(Ferrocenyl)hexanethiol)?

The canonical SMILES is [CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][C]([CH]1)CCCCCCS.[Fe].

What is the hydrogen bond donor count of (056-(Ferrocenyl)hexanethiol)?

The hydrogen bond donor count is 1.

What is the hydrogen bond acceptor count of (056-(Ferrocenyl)hexanethiol)?

The hydrogen bond acceptor count is 1.

Is (056-(Ferrocenyl)hexanethiol) canonicalized?

Yes, (056-(Ferrocenyl)hexanethiol) is canonicalized.

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