25312-34-9
Product Name:
α-Ionol
Formula:
C13H22O
Synonyms:
4-(2,6,6-Trimethyl-2-cyclohexenyl)-3-buten-2-ol
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CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless liquid with a sweeter odour of ionones |
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Boiling Point | 127.00 °C. @ 15.00 mm Hg |
Density | 0.917-0.924 |
Refractive Index | 1.488-1.492 |
Kovats Retention Index | 1376 1387 1392 1392 |
COMPUTED DESCRIPTORS
Molecular Weight | 194.31 g/mol |
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XLogP3 | 3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 2 |
Exact Mass | 194.167065321 g/mol |
Monoisotopic Mass | 194.167065321 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 248 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
4,7-Megastigmadien-9-ol is a sesquiterpenoid.