trans-4-(5-Propyl-1,3-dioxan-2-yl)benzonitrile

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Catalog Number
ACM74240645
Product Name
trans-4-(5-Propyl-1,3-dioxan-2-yl)benzonitrile
Structure
Structure
CAS
74240-64-5
Category
Heterocyclic Organic Compound
Synonyms
PDX-3;TRANS-4-(5-PROPYL-1,3-DIOXAN-2-YL)BENZONITRILE;TRANS-2-(4-CYANOPHENYL)-5-N-PROPYL-1,3-DIOXANE;4-(5-propyl-1,3-dioxan-2-yl)-, trans-Benzonitrile;ZLI-1906;4-(5α-Propyl-1,3-dioxane-2β-yl)benzonitrile
IUPAC Name
4-(5-propyl-1,3-dioxan-2-yl)benzonitrile
Molecular Weight
231.29
Molecular Formula
C14H17NO2
Canonical SMILES
CCCC1COC(OC1)C2=CC=C(C=C2)C#N
InChI Key
GQPFCPRCGONDNN-UHFFFAOYSA-N
Boiling Point
366.3ºC at 760 mmHg
Flash Point
132.7ºC
Density
1.1 g/cm³
EC Number
277-786-9
Exact Mass
231.12600
H-Bond Acceptor
3
H-Bond Donor
0
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