2-methyl-4-(3-oxobutyl)-4H-isoquinoline-1,3-dione

Modify Date: 2025-10-08 19:37:38

2-methyl-4-(3-oxobutyl)-4H-isoquinoline-1,3-dione Structure
2-methyl-4-(3-oxobutyl)-4H-isoquinoline-1,3-dione structure
Common Name 2-methyl-4-(3-oxobutyl)-4H-isoquinoline-1,3-dione
CAS Number 85364-37-0 Molecular Weight 245.27400
Density 1.179g/cm3 Boiling Point 415.1ºC at 760 mmHg
Molecular Formula C14H15NO3 Melting Point N/A
MSDS N/A Flash Point 190.2ºC

 Names

Name 2-methyl-4-(3-oxobutyl)-4H-isoquinoline-1,3-dione

 Chemical & Physical Properties

Density 1.179g/cm3
Boiling Point 415.1ºC at 760 mmHg
Molecular Formula C14H15NO3
Molecular Weight 245.27400
Flash Point 190.2ºC
Exact Mass 245.10500
PSA 54.45000
LogP 1.68950
Index of Refraction 1.543
InChIKey MZCFNJYOSFDDDC-UHFFFAOYSA-N
SMILES CC(=O)CCC1C(=O)N(C)C(=O)c2ccccc21

 Synthetic Route

~%

2-methyl-4-(3-oxobutyl)-4H-isoquinoline-1,3-dione Structure

2-methyl-4-(3-o...

CAS#:85364-37-0

Literature: Iida, Hideo; Takahashi, Toshiyuki; Narimiya, Mamoru; Takayanagi, Hiroshi; Kikuchi, Toyohiko Heterocycles, 1983 , vol. 20, # 2 p. 227 - 230

 Precursor & DownStream

Precursor  2

DownStream  0

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