4-(4-Methoxyphenyl)cyclohexanone

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Catalog Number
ACM5309160
Product Name
4-(4-Methoxyphenyl)cyclohexanone
Structure
Structure
CAS
5309-16-0
Category
Heterocyclic Organic Compound
Synonyms
4-(4-methoxyphenyl)cyclohexanone
IUPAC Name
4-(4-methoxyphenyl)cyclohexan-1-one
Molecular Weight
204.26g/mol
Molecular Formula
C13H16O2
Canonical SMILES
COC1=CC=C(C=C1)C2CCC(=O)CC2
InChI
InChI=1S/C13H16O2/c1-15-13-8-4-11(5-9-13)10-2-6-12(14)7-3-10/h4-5,8-10H,2-3,6-7H2,1H3
InChI Key
ZMMQLFXRGHSTSW-UHFFFAOYSA-N
Complexity
207
Covalently-Bonded Unit Count
1
EC Number
610-959-2
Exact Mass
204.11503g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
0
Heavy Atom Count
15
Monoisotopic Mass
204.11503g/mol
Rotatable Bond Count
2
XLogP3
2.1
MSDS
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COA
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Spec Sheet
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