Benzonitrile,4-(5-pentyl-1,3-dioxan-2-yl)-

CAS

74800-62-7

Catalog Number

ACM74800627

Category

Other Products

Molecular Weight

259.34

Molecular Formula

C₁₆H₂₁NO₂

MSDS COA Spec Sheet

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Specification

Synonyms

MolPort-004-285-212, ZINC02565420, EINECS 278-001-2, CID543324, 4-(5-Pentyl-1,3-dioxan-2-yl)benzonitrile, LT00080429, Benzonitrile, 4-(5-pentyl-1,3-dioxan-2-yl)-, 74800-62-7

IUPAC Name

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

Canonical SMILES

CCCCCC1COC(OC1)C2=CC=C(C=C2)C#N

InChI Key

SSXIKUCDZOQOKB-UHFFFAOYSA-N

Boiling Point

393ºC at 760 mmHg

Melting Point

56-58ºC

Flash Point

134.9ºC

Density

1.07g/cm³

EC Number

278-001-2

Exact Mass

259.15700

H-Bond Acceptor

H-Bond Donor

Packing Group

III

Safety Description

22-36/37/39

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