methyl 4-oxoisothiochroman-3-carboxylate

Modify Date: 2025-11-30 18:12:31

methyl 4-oxoisothiochroman-3-carboxylate Structure
methyl 4-oxoisothiochroman-3-carboxylate structure
Common Name methyl 4-oxoisothiochroman-3-carboxylate
CAS Number 59961-17-0 Molecular Weight 222.26000
Density 1.308g/cm3 Boiling Point 370ºC at 760 mmHg
Molecular Formula C11H10O3S Melting Point N/A
MSDS N/A Flash Point 185.1ºC

 Names

Name methyl 4-oxo-1H-isothiochromene-3-carboxylate

 Chemical & Physical Properties

Density 1.308g/cm3
Boiling Point 370ºC at 760 mmHg
Molecular Formula C11H10O3S
Molecular Weight 222.26000
Flash Point 185.1ºC
Exact Mass 222.03500
PSA 68.67000
LogP 1.65770
Index of Refraction 1.594
InChIKey ZABHGNJADRQSKO-UHFFFAOYSA-N
SMILES COC(=O)C1SCc2ccccc2C1=O

 Precursor & DownStream

Precursor  0

DownStream  2

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