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Substance Name: 1-Phenylpyrrolidine
RN: 4096-21-3
InChIKey: VDQQJMHXZCMNMU-UHFFFAOYSA-N

Molecular Formula

  • C10-H13-N

Molecular Weight

  • 147.22
 
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Names and Synonyms

Synonym

  • EINECS 223-849-0

Systematic Name

  • 1-Phenylpyrrolidine

Registry Numbers

CAS Registry Number

  • 4096-21-3

System Generated Number

  • 0004096213

Structure Descriptors

InChI

1S/C10H13N/c1-2-6-10(7-3-1)11-8-4-5-9-11/h1-3,6-7H,4-5,8-9H2

InChIKey

VDQQJMHXZCMNMU-UHFFFAOYSA-N

Smiles

C1CCCN1c1ccccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
pKa Dissociation Constant 9.7 (none)   EXP
log P (octanol-water) 3.56 (none)   EXP
Water Solubility 71.1 mg/L 25 EST
Vapor Pressure 0.080 mm Hg 25 EST
Henry's Law Constant 6.66E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.62E-10 cm3/molecule-sec 25 EST

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