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CAS Number: 5961-55-7
4-methoxy-1-naphthonitrile

Structure

4-methoxy-1-naphthonitrile
Name: 4-methoxy-1-naphthonitrile
Synonyms:
General Information
Product Number: 5961557

CAS Registry Number 5961-55-7
Name:
1-​Naphthalenecarbonitr​ile, 4-​methoxy-
1-Naphthonitrile, 4-methoxy- (7CI,8CI)
1-Cyano-4-methoxynaphthalene
4-Methoxy-1-naphthalenecarbonitrile
4-Methoxy-1-naphthonitrile

 

Chemical Formula: C12H9NO
Exact Mass: 183.07
Molecular Weight: 183.21
m/z: 183.07 (100.0%), 184.07 (13.5%)

 

InChI:InChI=1S/C12H9NO/c1-14-12-7-6-9(8-13)10-4-2-3-5-11(10)12/h2-7H,1H3

InChI Key:FRCZUGOIGNQOID-UHFFFAOYSA-N

Canonical SMILES:COC1=CC=C(C2=CC=CC=C21)C#N

 

Thermal Properties Value Condition Note
Melting Point 105 °C   (9)IC
Melting Point 104 °C Solv: benzene (71-43-2) (10)CAS
Melting Point 101-102 °C   (11)IC
Melting Point 100-102 °C   (6)CAS

Specification

98%

References
  1. (6) Ushijima, Sousuke; Synlett 2010, (7), P1067-1070 CAPLUS
  2. (9) Karmarkar, Sanjay N.; Synthesis 1985, (5), P510-12 CAPLUS
  3. (10) Lorz, Emil; Journal of the American Chemical Society 1951, V73, P93-5 CAPLUS
  4. (11) 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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