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Home> Encyclopedia > Hot Product Listed 6   > 6-Quinoxalinecarbonitrile,1,2,3,4-tetrahydro-
6336-45-4 structure

6-Quinoxalinecarbonitrile,1,2,3,4-tetrahydro-

Iupac Name:dibutoxy(ethenyl)borane
CAS No.:6336-45-4
Molecular Weight:184.08354
Molecular Formula:C16H17N3O2S (isomer)
Names and Identifiers
Synonyms

1,2,3,4-tetrahydroquinoxaline-6-carbonitrile 6-Quinoxalinecarbonitrile, 1,2,3,4-tetrahydro- AK459495 AKOS027414097

Inchi
InChI=1/C10H21BO2/c1-4-7-9-12-11(6-3)13-10-8-5-2/h6H,3-5,7-10H2,1-2H3
Canonical Smiles
B(C=C)(OCCCC)OCCCC
Properties
Refractive Index
n20/D 1.4180(lit.)
HS Code
2931900090
Safety and Handling
Risk Statements
36/37/38
Safety Statements
26
Computational chemical data
  • Molecular Weight:184.08354g/mol
  • Molecular Formula:C16H17N3O2S
  • Exact Mass:184.16346
  • Monoisotopic Mass:184.16346
  • Complexity:108
  • Rotatable Bond Count:9
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:18.5
  • Heavy Atom Count:13
  • 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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