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Substance Name: 5-Chrysenecarboxylic acid, methyl ester
RN: 71431-97-5
InChIKey: BTMIXCXECURAKO-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C20-H14-O2

Molecular Weight

  • 286.329
 
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Names and Synonyms

Synonyms

  • 3-09-00-03622 (Beilstein Handbook Reference)
  • 5-(Carboxymethyl)chrysene
  • 5-Carbomethoxychrysene
  • BRN 2138350
  • Methyl 5-chrysenecarboxylate

Systematic Name

  • 5-Chrysenecarboxylic acid, methyl ester

Registry Numbers

CAS Registry Number

  • 71431-97-5

System Generated Number

  • 0071431975

Structure Descriptors

InChI

1S/C20H14O2/c1-22-20(21)18-12-14-7-3-4-8-15(14)17-11-10-13-6-2-5-9-16(13)19(17)18/h2-12H,1H3

InChIKey

BTMIXCXECURAKO-UHFFFAOYSA-N

Smiles

c12c(c3c(cccc3)cc2C(OC)=O)ccc2c1cccc2