(+)-2-Azabicyclo[2.2.1]hept-5-en-3-one

CAS Registry Number®

130931-83-8
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CAS Name

(+)-2-Azabicyclo[2.2.1]hept-5-en-3-one

Molecular Formula

C6H7NO

Molecular Mass

109.13

Cite this Page

(+)-2-Azabicyclo[2.2.1]hept-5-en-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=130931-83-8 (retrieved 2024-04-28) (CAS RN: 130931-83-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    93-95 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H7NO/c8-6-4-1-2-5(3-4)7-6/h1-2,4-5H,3H2,(H,7,8)/t4-,5+/m0/s1

InChIKey

InChIKey=DDUFYKNOXPZZIW-CRCLSJGQSA-N

SMILES

O=C1[C@@]2(C[C@](N1)(C=C2)[H])[H]

Canonical SMILES

O=C1NC2C=CC1C2

Other Names for this Substance

  • 2-Azabicyclo[2.2.1]hept-5-en-3-one, (1S,4R)-
  • 2-Azabicyclo[2.2.1]hept-5-en-3-one, (1S)-
  • (1S,4R)-2-Azabicyclo[2.2.1]hept-5-en-3-one
  • (1S)-(+)-2-Azabicyclo[2.2.1]hept-5-en-3-one
  • (1S,4R)-(+)-2-Azabicyclo[2.2.1]hept-5-en-3-one

Deleted or Replaced CAS Registry Numbers

1212450-72-0, 1276016-84-2, 1315057-11-4, 1354217-90-5, 1787294-06-7, 1933725-30-4, 2104845-61-4, 2180124-23-4, 2649107-73-1

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