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Substance Name: beta-Aminopropionitrile fumarate
RN: 1119-28-4
InChIKey: NYPGBHKJFKQTIY-TYYBGVCCSA-N

Molecular Formula

  • C4-H4-O4.x-C3-H6-N2

Molecular Weight

  • 186.166
 
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Names and Synonyms

Name of Substance

  • beta-Aminopropionitrile fumarate

Synonyms

  • BAPN fumarate
  • beta-Aminopropionitrile fumarate
  • beta-Aminopropionitryl-fumarate

Systematic Name

  • Propanenitrile, 3-amino-, (E)-2-butenedioate

Registry Numbers

CAS Registry Number

  • 1119-28-4

Related Registry Numbers

  • 2079-89-2 (fumarate[2:1])
  • 352-96-5 (fumarate [1:1])

System Generated Number

  • 0001119284

Molecular Formulas

Molecular Formula

  • C4-H4-O4.x-C3-H6-N2

Molecular Formula Fragments

  • C3-H6-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C4H4O4.C3H6N2/c5-3(6)1-2-4(7)8;4-2-1-3-5/h1-2H,(H,5,6)(H,7,8);1-2,4H2/b2-1+;

InChIKey

NYPGBHKJFKQTIY-TYYBGVCCSA-N

Smiles

NCCC#N.OC(\C=C\C(O)=O)=O