4'-Cyano-5-(5,5-dimethyl-1,3-dioxan-2-yl)valerophenone

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Catalog Number
ACM898756804
Product Name
4'-Cyano-5-(5,5-dimethyl-1,3-dioxan-2-yl)valerophenone
Structure
Structure
CAS
898756-80-4
Category
Heterocyclic Organic Compound
Synonyms
4'-CYANO-5-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)VALEROPHENONE
IUPAC Name
4-[5-(5,5-dimethyl-1,3-dioxan-2-yl)pentanoyl]benzonitrile
Molecular Weight
301.38
Molecular Formula
C18H23NO3
Canonical SMILES
CC1(COC(OC1)CCCCC(=O)C2=CC=C(C=C2)C#N)C
InChI Key
DCGYZEVCPQSTDD-UHFFFAOYSA-N
Boiling Point
450.6ºC at 760 mmHg
Flash Point
196.6ºC
Density
1.1g/cm³
Exact Mass
301.16800
H-Bond Acceptor
4
H-Bond Donor
0
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