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Substance Name: N-Benzylethanolamine
RN: 104-63-2
UNII: 48121MS9JM
InChIKey: XNIOWJUQPMKCIJ-UHFFFAOYSA-N

Molecular Formula

  • C9-H13-N-O

Molecular Weight

  • 151.208
 
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Names and Synonyms

Name of Substance

  • N-Benzylethanolamine

Synonyms

  • 2-(Benzylamino)ethanol
  • AI3-26796
  • Benzyl ethanolamine
  • Benzylaminoethanol
  • Benzylethanolamine
  • EINECS 203-221-2
  • N-Benzylethanolamine
  • NSC 11271
  • UNII-48121MS9JM

Systematic Names

  • 2-Benzylaminoethanol
  • Ethanol, 2-((phenylmethyl)amino)-
  • Ethanol, 2-(benzylamino)- (8CI)

Registry Numbers

CAS Registry Number

  • 104-63-2

FDA UNII

  • 48121MS9JM

Related Registry Number

  • 58576-72-0 (hydrochloride)

System Generated Number

  • 0000104632

Structure Descriptors

InChI

1S/C9H13NO/c11-7-6-10-8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2

InChIKey

XNIOWJUQPMKCIJ-UHFFFAOYSA-N

Smiles

OCCNCc1ccccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.79 (none)   EXP
Water Solubility 1.62E+05 mg/L 25 EST
Vapor Pressure 3.72E-04 mm Hg 25 EST
Henry's Law Constant 6.52E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.14E-11 cm3/molecule-sec 25 EST

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