1-pentyl-3,1-benzoxazine-2,4-dione

Modify Date: 2025-09-01 06:52:02

1-pentyl-3,1-benzoxazine-2,4-dione Structure
1-pentyl-3,1-benzoxazine-2,4-dione structure
Common Name 1-pentyl-3,1-benzoxazine-2,4-dione
CAS Number 57384-48-2 Molecular Weight 233.26300
Density 1.175g/cm3 Boiling Point 350.8ºC at 760 mmHg
Molecular Formula C13H15NO3 Melting Point N/A
MSDS N/A Flash Point 166ºC

 Names

Name 1-pentyl-3,1-benzoxazine-2,4-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.175g/cm3
Boiling Point 350.8ºC at 760 mmHg
Molecular Formula C13H15NO3
Molecular Weight 233.26300
Flash Point 166ºC
Exact Mass 233.10500
PSA 52.21000
LogP 2.14490
Index of Refraction 1.542
InChIKey JRKZMGQUTSBYPR-UHFFFAOYSA-N
SMILES CCCCCN1C2=CC=CC=C2C(=O)OC1=O

 Synthetic Route

~71%

1-pentyl-3,1-benzoxazine-2,4-dione Structure

1-pentyl-3,1-be...

CAS#:57384-48-2

Literature: Wube, Abraham A.; Bucar, Franz; Hochfellner, Christina; Blunder, Martina; Bauer, Rudolf; Huefner, Antje European Journal of Medicinal Chemistry, 2011 , vol. 46, # 6 p. 2091 - 2101

~43%

1-pentyl-3,1-benzoxazine-2,4-dione Structure

1-pentyl-3,1-be...

CAS#:57384-48-2

Literature: KAKEN PHARMACEUTICAL CO., LTD. Patent: EP2168951 A1, 2010 ; Location in patent: Page/Page column 47 ;

~%

1-pentyl-3,1-benzoxazine-2,4-dione Structure

1-pentyl-3,1-be...

CAS#:57384-48-2

Literature: Hardtmann; Koletar; Pfister Journal of Heterocyclic Chemistry, 1975 , vol. 12, # 3 p. 565 - 572

 Synonyms

N-pentylisatoic acid anhydride
Benz-3,1-oxazine-2,4-dione,1-pentyl
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