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Substance Name: Ferrocenemethanol, alpha-methyl-
RN: 1277-49-2
InChIKey: OATGCGMWYIPHOI-UHFFFAOYSA-N

Molecular Formula

  • C12-H14-Fe-O

Molecular Weight

  • 222.0234
 
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Names and Synonyms

Synonyms

  • (alpha-Hydroxyethyl)ferrocene
  • 1-Ferrocenylethanol
  • 1-Hydroxyethylferrocene
  • Ethanol, 1-ferrocenyl-
  • Ferrocene, (1-hydroxyethyl)-
  • NSC 162110

Systematic Names

  • Ferrocene, (1-hydroxyethyl)- (9CI)
  • Ferrocenemethanol, alpha-methyl-

Registry Numbers

CAS Registry Number

  • 1277-49-2

System Generated Number

  • 0001277492

Structure Descriptors

InChI

1S/C7H5O.C5.Fe/c1-6(8)7-4-2-3-5-7;1-2-4-5-3-1;/h6,8H,1H3;;/q2*-1;+2

InChIKey

OATGCGMWYIPHOI-UHFFFAOYSA-N

Smiles

CC([CH-]12C3=C4[Fe+2]3156789(C4=C52)[c-]1c6c7c8c19)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08813,