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CAS Number: 20927-96-2
dibenzo[b,d]furan-2-carbonitrile

Structure

dibenzo[b,d]furan-2-carbonitrile
Name: dibenzo[b,d]furan-2-carbonitrile
Synonyms:
General Information
Product Number: 20927962

CAS Registry Number 20927-96-2
Name:
2-​Dibenzofurancarbonit​rile

 

Chemical Formula: C13H7NO
Exact Mass: 193.05
Molecular Weight: 193.20
m/z: 193.05 (100.0%), 194.06 (14.2%), 195.06 (1.1%)

 

InChI:InChI=1S/C13H7NO/c14-8-9-5-6-13-11(7-9)10-3-1-2-4-12(10)15-13/h1-7H

InChI Key:JMLMVVOQPAPVOQ-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)C#N

 

Thermal Properties Value Condition Note
Melting Point 145-146 °C   (2)CAS
Melting Point 141-143 °C Solv: ethanol (64-17-5) (4)IC
Melting Point 137.5-138 °C   (5)CAS
Melting Point See full text   (3)CAS

Specification

98%

References
  1. (2) Xu, Hui; Chemical & Pharmaceutical Bulletin 2008, V56(10), P1496-1498 CAPLUS
  2. (3) Black, Michael; Organic & Biomolecular Chemistry 2010, V8(13), P2961-2967 CAPLUS
  3. (4) Ames, D. E.; Synthesis 1983, (3), P234-5 CAPLUS
  4. (5) Kuroki, Masatane; Nippon Kagaku Zasshi 1968, V89(5), P527-9 CAPLUS
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