CAS
149 Purity
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149 Purity
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Irisone
CAS
14901-07-6
Catalog Number
ACM14901076
Category
Other Products
Molecular Weight
192.30
Molecular Formula
C13H20O
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Specification
Synonyms
BETA-IONONE, .beta.-Ionone, beta-Ionon, beta-E-Ionone, trans-beta-Ionone, .beta.-Ionene, trans-.beta.-Ionone, beta-IRISONE, (E)-beta-Ionone, Ionone, .beta.-, IONONE, IONONE, BETA, beta-Cyclocitrylideneacetone, .beta.-Ionone isomer # 1, .beta.-Ionone isomer # 2, CCRIS 6249, I12603_ALDRICH, .beta.-Cyclocitrylideneacetone, W259500_ALDRICH, W259519_ALDRICH
IUPAC Name
(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one
Canonical SMILES
CC1=C(C(CCC1)(C)C)C=CC(=O)C
InChI Key
PSQYTAPXSHCGMF-BQYQJAHWSA-N
Boiling Point
126 - 128ºC at 12 mmHg
Melting Point
-49ºC
Flash Point
122ºC
Density
0.944
Appearance
clear to light yellow liquid with an odour of violets
EC Number
238-969-9
Exact Mass
192.15100
Hazard Statements
Xi: Irritant;N: Dangerous for the environment;
H-Bond Acceptor
1
H-Bond Donor
0
Packing Group
II; III
Safety Description
61-36/37/39-27-26
Stability
Stable under normal temperatures and pressures.
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