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Substance Name: 1-Naphthalenecarbonitrile
RN: 86-53-3
UNII: 2AS1LZ61HD
InChIKey: YJMNOKOLADGBKA-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C11-H7-N

Molecular Weight

  • 153.183
 
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Names and Synonyms

Name of Substance

  • 1-Naphthalenecarbonitrile

Synonyms

  • 1-Cyanonaphthalene
  • 1-Naphthalenecarbonitrile
  • 1-Naphthalenenitrile
  • 1-Naphthonitrile
  • 1-Naphthylnitrile
  • AI3-07035
  • alpha-Cyanonaphthalene
  • alpha-Naphthonitrile
  • alpha-Naphthylnitrile
  • EINECS 201-679-8
  • NSC 60230
  • UNII-2AS1LZ61HD

Systematic Names

  • 1-Naphthalenecarbonitrile
  • 1-Naphthonitrile

Registry Numbers

CAS Registry Number

  • 86-53-3

FDA UNII

  • 2AS1LZ61HD

System Generated Number

  • 0000086533

Structure Descriptors

InChI

1S/C11H7N/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H

InChIKey

YJMNOKOLADGBKA-UHFFFAOYSA-N

Smiles

c12c(cccc1C#N)cccc2

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 37.5 deg C   EXP
Boiling Point 299 deg C   EXP
log P (octanol-water) 2.720 (none)   EST
Atmospheric OH Rate Constant 3.81E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.