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CAS Number: 51849-33-3
1,2,3,4-tetrahydronaphthalene-2-carbonitrile

Structure

 1,2,3,4-tetrahydronaphthalene-2-carbonitrile
Name: 1,2,3,4-tetrahydronaphthalene-2-carbonitrile
Synonyms:
General Information
Product Number: 51849333

CAS Registry Number 51849-33-3
Name:
2-?Naphthalenecarbonitr?ile, 1,?2,?3,?4-?tetrahydro-
2-Naphthonitrile, 1,2,3,4-tetrahydro- (7CI)
1,2,3,4-Tetrahydro-2-naphthalenecarbonitrile

 

Chemical Formula: C11H11N
Exact Mass: 157.09
Molecular Weight: 157.21
m/z: 157.09 (100.0%), 158.09 (12.3%)

 

InChI:InChI=1S/C11H11N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-4,9H,5-7H2

InChI Key:COWCJTPCHIGSPT-UHFFFAOYSA-N

Canonical SMILES:C1CC2=CC=CC=C2CC1C#N

 

Thermal Properties Value Condition Note
Boiling Point 92 °C Press: 0.08 Torr (1)CAS
Boiling Point 85 °C Press: 0.11 Torr (2)IC
Melting Point 55 °C Solv: ligroine (8032-32-4); ethyl acetate (141-78-6) (1)CAS
Melting Point 54-55 °C   (5)CAS

Specification

98%
References
  1. (1) Alder, K.; Tetrahedron 1961, V14, P190-200 CAPLUS
  2. (2) Inaba, Shinichi; Journal of Organic Chemistry 1988, V53(2), P339-44 CAPLUS
  3. (5) Shishido, Keiichi; Journal of Polymer Science 1963, VPt. A 1(6), P2102-7 CAPLUS
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