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Substance Name: 2-Heptene-4,6-diyn-1-ol, 7-phenyl-, acetate
RN: 20252-43-1
InChIKey: JEAKICNMCJBNSA-UHFFFAOYSA-N

Molecular Weight

  • 224.258
 
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Names and Synonyms

  • 2-Heptene-4,6-diyn-1-ol, 7-phenyl-, acetate

Registry Numbers

CAS Registry Number

  • 20252-43-1

System Generated Number

  • 0020252431

Structure Descriptors

InChI

1S/C15H12O2/c1-14(16)17-13-9-4-2-3-6-10-15-11-7-5-8-12-15/h4-5,7-9,11-12H,13H2,1H3

InChIKey

JEAKICNMCJBNSA-UHFFFAOYSA-N

Smiles

C(OC\C=C/C#CC#Cc1ccccc1)(=O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.88 (none)   EXP
Water Solubility 15.9 mg/L 25 EST
Vapor Pressure 3.10E-05 mm Hg 25 EST
Henry's Law Constant 2.82E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.41E-10 cm3/molecule-sec 25 EST

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