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Home> Encyclopedia > Hot Product Listed 2   > 2-Naphthalenecarbonitrile,5,6-dihydro-6,6-dimethyl-5-oxo-8-(2-oxo-1(2H)-pyridinyl)-
32084-53-0 structure

2-Naphthalenecarbonitrile,5,6-dihydro-6,6-dimethyl-5-oxo-8-(2-oxo-1(2H)-pyridinyl)-

CAS No.:32084-53-0
Molecular Weight:224.23642
Molecular Formula:C18H13N3NA2O8S2 (isomer)
Names and Identifiers
Synonyms

UR 8225

Inchi
InChI=1/C9H8N2O3S/c1-2-14-8(13)6-5-10-9-11(7(6)12)3-4-15-9/h3-5H,2H2,1H3
Canonical Smiles
CCOC(=O)C1=CN=C2N(C1=O)C=CS2
Properties
Density
1.04
Melting Point
175 °C
Refractive Index
1.675
Flash Point
°C
HS Code
2934100090
Safety and Handling
Safety Statements
Hazard Note Harmful
Computational chemical data
  • Molecular Weight:224.23642g/mol
  • Molecular Formula:C18H13N3NA2O8S2
  • XLogP3-AA:0.3
  • Exact Mass:224.025563
  • Monoisotopic Mass:224.025563
  • Complexity:412
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:84.3
  • Heavy Atom Count:15
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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Recommended Suppliers
  • Tel:86-755-33239182
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  • Tel:+44 (0) 1204 527 700
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