2-isoquinolin-1-yl-5-phenyl-4-sulfo-1H-pyrrole-3-carboxylic acid

Modify Date: 2025-11-18 19:44:02

2-isoquinolin-1-yl-5-phenyl-4-sulfo-1H-pyrrole-3-carboxylic acid Structure
2-isoquinolin-1-yl-5-phenyl-4-sulfo-1H-pyrrole-3-carboxylic acid structure
Common Name 2-isoquinolin-1-yl-5-phenyl-4-sulfo-1H-pyrrole-3-carboxylic acid
CAS Number 13226-16-9 Molecular Weight 417.39000
Density 1.511g/cm3 Boiling Point N/A
Molecular Formula C20H14N2NaO5S+ Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-(isoquinolin-1-yl)-5-phenyl-4-sulfo-1H-pyrrole-3-carboxylic acid, sodium salt

 Chemical & Physical Properties

Density 1.511g/cm3
Molecular Formula C20H14N2NaO5S+
Molecular Weight 417.39000
Exact Mass 417.05200
PSA 128.73000
LogP 4.92260
InChIKey FHHSMKRSJFYTNU-UHFFFAOYSA-N
SMILES O=C(O)c1c(-c2nccc3ccccc23)[nH]c(-c2ccccc2)c1S(=O)(=O)O.[Na+]
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