Skip Navigation

U.S. National Library of Medicine

TOXNET - TOXICOLOGY DATA NETWORK

2D chemical structure of 1273-94-5

Substance Name: Ferrocene, 1,1'-diacetyl-
RN: 1273-94-5
InChIKey: JNBIZDIDVCJECQ-UHFFFAOYSA-N

Molecular Formula

C14-H14-Fe-O2

Molecular Weight

270.108

All
Links to Resources
Names & Synonyms
Registry Numbers
Structure Descriptors
Toxicity

* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

PubChem

TOXLINE

Other Resources (Internet Locators)

EPA ACToR

NIST WebBook

Search for this InChIKey on the Web

Names and Synonyms

Synonyms

1,1'-Diacetylferrocene

AI3-61449

NSC 16677

NSC 511707

Systematic Name

Ferrocene, 1,1'-diacetyl-

Registry Numbers

CAS Registry Number

1273-94-5

System Generated Number

0001273945

Structure Descriptors

InChI

1S/2C7H7O.Fe/c2*1-6(8)7-4-2-3-5-7;/h2*2-5H,1H3;

InChIKey

JNBIZDIDVCJECQ-UHFFFAOYSA-N

Smiles

[Fe]12345678(C9(C(=O)C)[C@@H]3[C@@H]6[C@@H]5[C@@H]19)C1(C(=O)C)[C@@H]4[C@@H]8[C@@H]7[C@@H]21

Toxicity

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mammal (species unspecified)	LDLo	intratracheal	50mg/kg (50mg/kg)	BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) KIDNEY, URETER, AND BLADDER: INCONTINENCE	"Spravochnik po Toksikologii i Gigienicheskim Normativam Vol. -, Pg. 62, 1999.
mouse	LD50	intraperitoneal	90mg/kg (90mg/kg)	KIDNEY, URETER, AND BLADDER: INCONTINENCE BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)	"Spravochnik po Toksikologii i Gigienicheskim Normativam Vol. -, Pg. 62, 1999.
mouse	LD50	oral	680mg/kg (680mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD KIDNEY, URETER, AND BLADDER: INCONTINENCE	"Spravochnik po Toksikologii i Gigienicheskim Normativam Vol. -, Pg. 62, 1999.
rat	LD50	intraperitoneal	168mg/kg (168mg/kg)	BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) KIDNEY, URETER, AND BLADDER: INCONTINENCE	"Spravochnik po Toksikologii i Gigienicheskim Normativam Vol. -, Pg. 62, 1999.
rat	LD50	oral	1600mg/kg (1600mg/kg)	KIDNEY, URETER, AND BLADDER: INCONTINENCE BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)	"Spravochnik po Toksikologii i Gigienicheskim Normativam Vol. -, Pg. 62, 1999.