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Substance Name: 6-Amino-1,2-benzopyrone
RN: 14415-44-2
UNII: S9W3L9R2NA
InChIKey: ZOJAINJCZSVZGW-UHFFFAOYSA-N

Note

  • Selective inhibitor of adenosine diphosphoribosyl transferase.

Molecular Formula

  • C9-H7-N-O2

Molecular Weight

  • 161.159
 
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Names and Synonyms

Name of Substance

  • 6-Amino-1,2-benzopyrone

Synonyms

  • 6-ABP
  • 6-Aminocoumarin
  • UNII-S9W3L9R2NA

Systematic Name

  • 2H-1-Benzopyran-2-one, 6-amino-

Registry Numbers

CAS Registry Number

  • 14415-44-2

FDA UNII

  • S9W3L9R2NA

Related Registry Number

  • 63989-79-7 (hydrochloride)

System Generated Number

  • 0014415442

Structure Descriptors

InChI

1S/C9H7NO2/c10-7-2-3-8-6(5-7)1-4-9(11)12-8/h1-5H,10H2

InChIKey

ZOJAINJCZSVZGW-UHFFFAOYSA-N

Smiles

O=c1oc2c(cc(cc2)N)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.600 (none)   EST
Water Solubility 2330 mg/L 37 EXP
Atmospheric OH Rate Constant 8.56E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.