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CAS Number: 110299-23-5
pyrene-1,6-dicarboxylic acid

Structure

pyrene-1,6-dicarboxylic acid
Name: pyrene-1,6-dicarboxylic acid
Synonyms:
General Information
Product Number: 110299235

CAS Registry Number 110299-23-5
Name:
1,​6-​Pyrenedicarboxylic acid

 

Chemical Formula: C18H10O4
Exact Mass: 290.06
Molecular Weight: 290.27
m/z: 290.06 (100.0%), 291.06 (19.7%), 292.06 (2.6%)

 

InChI:InChI=1S/C18H10O4/c19-17(20)13-8-4-10-2-6-12-14(18(21)22)7-3-9-1-5-11(13)16(10)15(9)12/h1-8H,(H,19,20)(H,21,22)

InChI Key:IJDIPICFINEEDN-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=CC3=C2C4=C1C=CC(=C4C=C3)C(=O)O)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 420 °C (decomp)   (1)CAS
Melting Point >280 °C Solv: chlorobenzene (108-90-7) (2)CAS

Specification

98%

References
  1. (1) Vollmann, Heinrich; Justus Liebigs Annalen der Chemie 1937, V531, P1-159 CAPLUS
  2. (2) Kollock, Ronny; Toxicology 2008, V245(1-2), P65-75 CAPLUS
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