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53-95-2

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Basic Information
CAS No.: 53-95-2
Name: Hydroxyacetylaminofluorene
Article Data: 12
Molecular Structure:
Molecular Structure of 53-95-2 (Hydroxyacetylaminofluorene)
Formula: C15H13 N O2
Molecular Weight: 239.274
Synonyms: Acetamide,N-fluoren-2-yl-N-hydroxy- (7CI); Acetohydroxamic acid, N-fluoren-2-yl-(6CI,8CI); 2-(N-Hydroxyacetamido)fluorene;N-(9H-Fluoren-2-yl)-N-hydroxyacetamide; N-2-Fluorenyl-N-hydroxyacetamide;N-2-Fluorenylacetohydroxamic acid; N-Acetyl-N-2-fluorenylhydroxylamine;N-Hydroxy-2-(acetylamino)fluorene; N-Hydroxy-AAF;N-Hydroxy-N-(2-fluorenyl)acetamide; NSC 46522
Density: 1.322g/cm3
Melting Point: 136 - 137 C
Boiling Point: 455.1°Cat760mmHg
Flash Point: 229°C
Solubility: Toxicity data
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Stability

    Stable. Incompatible with strong oxidizing agents.

Toxicology

    Experimental neoplastigen, carcinogen, tumorigen.

    Toxicity data
    (The meaning of any toxi

Appearance: cream powder
Safety: Suspected carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. A poison by intraperitoneal route. Experimental teratogenic and other reproductive effects. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
PSA: 40.54000
LogP: 2.99990
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Chemistry

Empirical Formula: C15H13NO2
Molecular Weight: 239.2692 
Index of Refraction: 1.696
Density: 1.322 g/cm3
Flash Point: 229 °C
Solubility: Insoluble in water
Appearance: Cream colored powder
Enthalpy of Vaporization: 75.32 kJ/mol
Boiling Point: 455.1 °C at 760 mmHg
Vapour Pressure: 4.51E-09 mmHg at 25 °C
Structure of Hydroxyacetylaminofluorene (CAS NO.53-95-2):
                     
IUPAC Name: N-(9H-Fluoren-2-yl)-N-hydroxyacetamide
Canonical SMILES: CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)O
InChI: InChI=1S/C15H13NO2/c1-10(17)16(18)13-6-7-15-12(9-13)8-11-4-2-3-5-14(11)15/h2-7,9,18H,8H2,1H3
InChIKey: SOKUIEGXJHVFDV-UHFFFAOYSA-N

Uses

 Hydroxyacetylaminofluorene (CAS NO.53-95-2) is a derivative of 2-acetylaminofluorene used as a biochemical tool in the study of carcinogenesis.

Toxicity Data With Reference

1.    

mmo-sat 1 µg/plate

     ENMUDM    Environmental Mutagenesis. 6 (Suppl 2)(1984),1.
2.    

dnd-hmn:hla 25 µmol/L

     MUREAV    Mutation Research. 89 (1981),95.
3.    

dns-hmn:oth 1 µmol/L

     JJIND8    JNCI, Journal of the National Cancer Institute. 72 (1984),847.
4.    

dnd-mus:lvr 20 µmol/L

     CRNGDP    Carcinogenesis. 5 (1984),797.
5.    

msc-ham:lng 25 µmol/L

     MUREAV    Mutation Research. 149 (1985),265.
6.    

ipr-gpg TDLo:4700 mg/kg/26W-I:CAR,TER

     CNREA8    Cancer Research. 24 (1964),2018.
7.    

ipr-rat LD50:52 mg/kg

     CNREA8    Cancer Research. 35 (1975),2959.
8.    

ipr-mus LD50:1500 mg/kg

     JJIND8    JNCI, Journal of the National Cancer Institute. 62 (1979),911.

Consensus Reports

EPA Genetic Toxicology Program.

Safety Profile

Suspected carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. A poison by intraperitoneal route. Experimental teratogenic and other reproductive effects. Human mutation data reported. When heated to decomposition Hydroxyacetylaminofluorene (CAS NO.53-95-2) emits toxic fumes of NOx.

Specification

 Hydroxyacetylaminofluorene , its cas register number is 53-95-2. It also can be called N-9H-Fluoren-2-yl-N-hydroxyacetamide ; Fluorenyl-2-acethydroxamic acid ; Hydroxyfluorenylacetamide ; and N-Hydroxy-2-acetamidofluorene . It is an amide that reacts with azo and diazo compounds to generate toxic gases.