Cas no 214759-65-6 (6-Cyano-4-chromanone)

6-Cyano-4-chromanone structure
6-Cyano-4-chromanone structure
Product Name:6-Cyano-4-chromanone
CAS No:214759-65-6
MF:C10H7NO2
MW:173.168082475662
MDL:MFCD05861625
CID:253806
PubChem ID:22349973
Update Time:2024-10-31

6-Cyano-4-chromanone Chemical and Physical Properties

Names and Identifiers

    • 2H-1-Benzopyran-7-carbonitrile,3,4-dihydro-4-oxo-
    • 4-oxo-2,3-dihydrochromene-6-carbonitrile
    • 6-CYANO-4-CHROMANONE
    • 3,4-DIHYDRO-4-OXO-2H-CHROMENE-6-CARBONITRILE
    • 4-OXOCHROMAN-6-CARBONITRILE
    • 4-oxochroman-7-carbonitrile
    • 4-OXOCHROMANE-6-CARBONITRILE
    • 7-cyano-4-chromanone
    • 4-oxo-3,4-dihydro-2H-chromene-7-carbonitrile
    • 4-Oxochromane-7-carbonitrile
    • 7-Cyanochroman-4-one
    • AS-57381
    • XLPCNXPFUOBSES-UHFFFAOYSA-N
    • 7-(cyano)-4-chromanone
    • MFCD05861625
    • 214759-65-6
    • CS-0035590
    • 4-oxo-3,4-dihydro-2H-1-benzopyran-7-carbonitrile
    • SCHEMBL1090921
    • AKOS006293971
    • AM806230
    • FT-0695685
    • 4-oxo-2,3-dihydrochromene-7-carbonitrile
    • SY124577
    • 6-Cyano-4-chromanone
    • MDL: MFCD05861625
    • Inchi: 1S/C10H7NO2/c11-6-7-1-2-8-9(12)3-4-13-10(8)5-7/h1-2,5H,3-4H2
    • InChI Key: XLPCNXPFUOBSES-UHFFFAOYSA-N
    • SMILES: O1C2C=C(C#N)C=CC=2C(CC1)=O

Computed Properties

  • Exact Mass: 173.04800
  • Monoisotopic Mass: 173.047678466g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 265
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.1
  • Topological Polar Surface Area: 50.1?2

Experimental Properties

  • PSA: 50.09000
  • LogP: 1.52348

6-Cyano-4-chromanone Pricemore >>

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Apollo Scientific
OR943666-250mg
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Apollo Scientific
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abcr
AB454832-250 mg
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€209.40 2023-04-22
abcr
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abcr
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