2-Allylcyclohexanone

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Catalog Number
ACM-MO-94666
Product Name
2-Allylcyclohexanone
Structure
Structure
CAS
94-66-6
Category
Heterocyclic Organic Compound
IUPAC Name
2-prop-2-enylcyclohexan-1-one
Molecular Weight
138.21 g/mol
Molecular Formula
C9H14O
Canonical SMILES
C=CCC1CCCCC1=O
InChI
InChI=1S/C9H14O/c1-2-5-8-6-3-4-7-9(8)10/h2,8H,1,3-7H2
InChI Key
UPGHEUSRLZSXAE-UHFFFAOYSA-N
Boiling Point
94 °C/23 mmHg
Appearance
Colorless to Light Yellow to Light Orange Clear Liquid
Storage
0-10 °C
Complexity
138
Condition To Avoid
Air Sensitive,Heat Sensitive
Covalently-Bonded Unit Count
1
EC Number
202-352-2
Exact Mass
138.104465g/mol
Formal Charge
0
H-Bond Acceptor
1
H-Bond Donor
0
Heavy Atom Count
10
Monoisotopic Mass
138.104465g/mol
NSC Number
128921
Physical State
Liquid
Refractive Index
1.47
Rotatable Bond Count
2
SpecificGravity
0.94
XLogP3
2.1
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