Apritone

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Catalog Number
ACM68133799
Product Name
Apritone
CAS
68133-79-9
Category
Heterocyclic Organic Compound
Synonyms
Geranyl cyclopentenone
IUPAC Name
2-[(2E)-3,7-Dimethylocta-2,6-dienyl]cyclopentan-1-one
Molecular Weight
220.35
Molecular Formula
C15H24O
Canonical SMILES
CC(=CCCC(=CCC1CCCC1=O)C)C
InChI
InChI=1S/C15H24O/c1-12(2)6-4-7-13(3)10-11-14-8-5-9-15(14)16/h6,10,14H,4-5,7-9,11H2,1-3H3/b13-10+
InChI Key
ZNSALEJHPSBXDK-JLHYYAGUSA-N
Boiling Point
309.9±11.0 °C
Flash Point
139 °C
Density
0.911±0.06 g/cm³
Solubility
Insoluble in water; soluble in fats
EC Number
268-706-3
Exact Mass
220.182715385
H-Bond Acceptor
1
H-Bond Donor
0
Isomeric SMILES
CC(=CCC/C(=C/CC1CCCC1=O)/C)C
Monoisotopic Mass
220.182715385
Odor
Long lasting apricot fruity note
Physical State
Liquid
Refractive Index
n20/D 1.482-1.489(lit.)
Topological Polar Surface Area
17.1 Ų
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