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213-46-7

Basic Information
CAS No.: 213-46-7
Name: Picene
Article Data: 55
Molecular Structure:
Molecular Structure of 213-46-7 (Picene)
Formula: C22H14
Molecular Weight: 278.353
Synonyms: 1,2:7,8-Dibenzophenanthrene;Benzo[a]chrysene; Dibenzo[a,i]phenanthrene; NSC 406006; [5]Phenacene
Density: 1.232g/cm3
Melting Point: 366-367°
Boiling Point: 519°Cat760mmHg
Flash Point: 264.5°C
Solubility: 2.5ug/L(27 oC)
Safety: Questionable carcinogen with experimental carcinogenic and neoplastigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.
PSA: 0.00000
LogP: 6.29940
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  • 213-46-7  CAS NO.213-46-7

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    CAS No. 213-46-7 Molecular formula: C22H14 Molecular weight: 278.35 Melting point 366-367 °C Boiling point: BP 518-520 °C Density 1.1489 (estimate) Refractive index 1.8120 (estimate) Storage Conditi

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  • 213-46-7  CAS NO.213-46-7

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Chemistry

MF: C22H14
MW: 278.35
EINECS: 205-918-7  
IUPAC Name: picene
Storage temp: 2-8°C
Density: 1.232 g/cm3
Flash Point: 264.5 °C
Index of Refraction: 1.811 
Enthalpy of Vaporization: 76.18 kJ/mol 
Boiling Point: 519 °C at 760 mmHg 
Vapour Pressure: 2.34E-10 mmHg at 25°C 
Product Categories: Alphabetic ; P ; PER - POLA
Synonyms: 1,2,7,8-Dibenzphenanthrene ; 3,4-Benzchrysene ; Benzo(a)chrysene ; benzo[a]chrysene ; Beta,beta-Binaphthyleneethene ; Dibenzo(a,i)phenanthrene
Following is the molecular structure of Picene (213-46-7):

Toxicity Data With Reference

1.    

skn-mus TDLo:15,142 µg/kg/112W-I:NEO

    CRNGDP    Carcinogenesis. 11 (1990),1721.
2.    

scu-mus TDLo:445 µg/kg:CAR

    CRNGDP    Carcinogenesis. 11 (1990),1721.

Safety Profile

Questionable carcinogen with experimental carcinogenic and neoplastigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.
Safety Information of Picene (213-46-7):
RIDADR: 2811
HazardClass: 6.1(b)
PackingGroup: III

Specification

Picene (213-46-7) is a hydrocarbon found in the pitchy residue obtained in the distillation of peat tar and of petroleum. This is distilled to dryness and the distillate repeatedly recrystallized from cymene. It may be synthetically prepared by the action of anhydrous aluminium chloride on a mixture of naphthalene and 1,2-dibromoethane, or by distilling a-dinaphthostilbene. It crystallizes in large colorless plates which possess a blue fluorescence. It is soluble in concentrated sulfuric acid with a green color. Chromic acid in glacial acetic acid solution oxidizes it to picene-quinone, picene-quinone carboxylic acid, and finally to phthalic acid.