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Isobutyl cinnamate

Catalog Number
ACM122678-1
Product Name
Isobutyl cinnamate
Structure
CAS
122-67-8
Category
Self Assembly and Lithography
Synonyms
Labdanol
Description
Colourless liquid, sweet fruity balsamic odour
IUPAC Name
2-Methylpropyl (E)-3-phenylprop-2-enoate
Molecular Weight
204.26
Molecular Formula
C13H16O2
Canonical SMILES
CC(C)COC(=O)C=CC1=CC=CC=C1
InChI
InChI=1S/C13H16O2/c1-11(2)10-15-13(14)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+
InChI Key
IQZUZPKOFSOVET-CMDGGOBGSA-N
Boiling Point
287 °C
Flash Point
237 °F
Purity
98%+
Density
1 g/mL at 25 °C(lit.)
Solubility
Insoluble in water; soluble in oils
Appearance
Colorless to pale yellow clear liquid (est)
Application
This product is suitable for scientific research.
Storage
room temp
Complexity
213
Covalently-Bonded Unit Count
1
EC Number
204-564-0
Exact Mass
204.115029749
Features And Benefits
1. High quality products
2. Fast delivery
3. Additional products can be ordered, please contact us for details
Formal Charge
0
Heavy Atom Count
15
MDL Number
MFCD00038289
Monoisotopic Mass
204.115029749
NSC Number
404181
Packaging
1 kg
Refractive Index
n20/D 1.54(lit.)
Rotatable Bond Count
5
Storage Conditions
Dry place,Room Temperature
Topological Polar Surface Area
26.3 Ų
UNII
4NCI0MR7KP
XLogP3
4
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