Cas no 27452-03-5 (3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile)

3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile structure
27452-03-5 structure
Product Name:3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile
CAS No:27452-03-5
MF:C10H8BrNO2
MW:254.080021858215
MDL:MFCD00094442
CID:2930398
PubChem ID:18467755
Update Time:2025-04-21

3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile Chemical and Physical Properties

Names and Identifiers

    • 3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile
    • RFIVKYGIWJLLBS-UHFFFAOYSA-N
    • 27452-03-5
    • AE-508/36398062
    • 3-(6-bromo-1,3-benzodioxol-5-yl)propanenitrile
    • SCHEMBL6987564
    • EN300-1997123
    • MDL: MFCD00094442
    • Inchi: 1S/C10H8BrNO2/c11-8-5-10-9(13-6-14-10)4-7(8)2-1-3-12/h4-5H,1-2,6H2
    • InChI Key: RFIVKYGIWJLLBS-UHFFFAOYSA-N
    • SMILES: BrC1=CC2=C(C=C1CCC#N)OCO2

Computed Properties

  • Exact Mass: 252.97384Da
  • Monoisotopic Mass: 252.97384Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 250
  • 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: 2.4
  • Topological Polar Surface Area: 42.3?2

3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1997123-0.05g
3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile
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$660.0 2023-09-16
Enamine
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Enamine
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$723.0 2023-09-16
Enamine
EN300-1997123-0.5g
3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile
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0.5g
$754.0 2023-09-16
Enamine
EN300-1997123-1.0g
3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile
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Enamine
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Enamine
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3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile
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$2277.0 2023-05-26
Enamine
EN300-1997123-10.0g
3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile
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Enamine
EN300-1997123-1g
3-(6-bromo-1,3-dioxaindan-5-yl)propanenitrile
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Enamine
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