Product Name

  • Name

    (1R,2S)-3-methyl-1,2-dihydrocyclopenta[ij]tetraphene-1,2-diol

  • EINECS
  • CAS No. 3342-99-2
  • Density 1.407g/cm3
  • Solubility
  • Melting Point
  • Formula C21H16O2
  • Boiling Point 591.6°Cat760mmHg
  • Molecular Weight 300.37
  • Flash Point 284.6°C
  • Transport Information
  • Appearance
  • Safety Questionable carcinogen with experimental neoplastigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.
  • Risk Codes
  • Molecular Structure Molecular Structure of 3342-99-2 ((1R,2S)-3-methyl-1,2-dihydrocyclopenta[ij]tetraphene-1,2-diol)
  • Hazard Symbols
  • Synonyms
  • PSA
  • LogP

cis-3-Methylcholanthrene-1,2-diol Chemical Properties

IUPAC Name: (1R,2S)-3-Methyl-1,2-dihydrobenzo[j]aceanthrylene-1,2-diol   
Following is the structure of cis-3-Methylcholanthrene-1,2-diol (CAS NO.3342-99-2):
                   
Empirical Formula: C21H16O2
Molecular Weight: 300.3505 g/mol
Surface Tension: 69.4 dyne/cm
Density: 1.407 g/cm3
Flash Point: 284.6 °C
Index of Refraction: 1.85
Enthalpy of Vaporization: 92.81 kJ/mol
Boiling Point: 591.6 °C at 760 mmHg
Vapour Pressure of cis-3-Methylcholanthrene-1,2-diol (CAS NO.3342-99-2): 7.63E-15 mmHg at 25 °C
Canonical SMILES: CC1=C2C(C(C3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1)O)O
Isomeric SMILES: CC1=C2[C@@H]([C@@H](C3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1)O)O
InChI: InChI=1S/C21H16O2/c1-11-6-7-13-10-16-14-5-3-2-4-12(14)8-9-15(16)19-18(13)17(11)20(22)21(19)23/h2-10,20-23H,1H3/t20-,21+/m0/s1
InChIKey: MSPGUHVGYWHMPY-LEWJYISDSA-N

cis-3-Methylcholanthrene-1,2-diol Safety Profile

Questionable carcinogen with experimental neoplastigenic data. When heated to decomposition, cis-3-Methylcholanthrene-1,2-diol (CAS NO.3342-99-2) emits acrid smoke and irritating fumes.

cis-3-Methylcholanthrene-1,2-diol Specification

 cis-3-Methylcholanthrene-1,2-diol , its cas register number is 3342-99-2. It also can be called Benz(j)aceanthrylene-1,2-diol, 1,2-dihydro-3-methyl-, cis- ; cis-1,2-Dihydroxy-3-methylcholanthrene ; and 1,2-Cholanthrenediol, cis-3-methyl- . Its classification code is Tumor data.

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