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Substance Name: 4-Methylbenzylamine
RN: 104-84-7
InChIKey: HMTSWYPNXFHGEP-UHFFFAOYSA-N

Molecular Formula

  • C8-H11-N

Molecular Weight

  • 121.182
 
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Names and Synonyms

Name of Substance

  • 4-Methylbenzylamine

Synonyms

  • 4-Methylbenzylamine
  • EINECS 203-243-2
  • NSC 66562
  • p-Methylbenzylamine

Systematic Names

  • 4-Methylbenzylamine
  • Benzenemethanamine, 4-methyl-
  • Benzylamine, p-methyl- (8CI)

Registry Numbers

CAS Registry Number

  • 104-84-7

System Generated Number

  • 0000104847

Structure Descriptors

InChI

1S/C8H11N/c1-7-2-4-8(6-9)5-3-7/h2-5H,6,9H2,1H3

InChIKey

HMTSWYPNXFHGEP-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)CN

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 12.5 deg C   EXP
Boiling Point 195 deg C   EXP
pKa Dissociation Constant 9.36 (none) 25 EXP
log P (octanol-water) 1.46 (none)   EXP
Water Solubility 5.73E+04 mg/L 25 EST
Vapor Pressure 0.298 mm Hg 25 EST
Henry's Law Constant 6.75E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.60E-11 cm3/molecule-sec 25 EST

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