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CAS Number: 20944-85-8
2-methyl-1-naphthonitrile

Structure

2-methyl-1-naphthonitrile
Name: 2-methyl-1-naphthonitrile
Synonyms:
General Information
Product Number: 20944858

CAS Registry Number 20944-85-8
Name:
1-​Naphthalenecarbonitr​ile, 2-​methyl-
1-Naphthonitrile, 2-methyl- (6CI,8CI)
1-Cyano-2-methylnaphthalene
2-Methylnaphthalene-1-carbonitrile
NSC 118082

 

Chemical Formula: C12H9N
Exact Mass: 167.07
Molecular Weight: 167.21
m/z: 167.07 (100.0%), 168.08 (13.1%)

 

InChI:InChI=1S/C12H9N/c1-9-6-7-10-4-2-3-5-11(10)12(9)8-13/h2-7H,1H3

InChI Key:MSGUYMCVLYTSNE-UHFFFAOYSA-N

Canonical SMILES:CC1=C(C2=CC=CC=C2C=C1)C#N

 

Thermal Properties Value Condition Note
Melting Point 87-88 °C   (4)CAS
Melting Point 86 °C Solv: ethanol (64-17-5) (5)IC
Melting Point 85-87 °C   (6)CAS
Melting Point 85-86 °C Solv: hexane (110-54-3) (3)IC
Melting Point 84-85 °C   (7)IC

Specification

98%

References
  1. (3) Fraser, R. R.; Canadian Journal of Chemistry 1986, V64(3), P621-5 CAPLUS
  2. (4) Fuson, Reynold C.; Journal of the American Chemical Society 1941, V63, P2648-9 CAPLUS
  3. (5) Gore, P. H.; Tetrahedron 1979, V35(24), P2927-9 CAPLUS
  4. (6) Eastham, Jerome F.; Journal of Organic Chemistry 1960, V25, P1504-6 CAPLUS
  5. (7) Yasuda, Masahide; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1981, (3), P746-50 CAPLUS
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