METHYL 5-NITRO-3-ISOQUINOLINECARBOXYLATE

Modify Date: 2025-08-27 08:38:15

METHYL 5-NITRO-3-ISOQUINOLINECARBOXYLATE Structure
METHYL 5-NITRO-3-ISOQUINOLINECARBOXYLATE structure
Common Name METHYL 5-NITRO-3-ISOQUINOLINECARBOXYLATE
CAS Number 581812-72-8 Molecular Weight 232.19200
Density 1.394g/cm3 Boiling Point 422.328ºC at 760 mmHg
Molecular Formula C11H8N2O4 Melting Point N/A
MSDS N/A Flash Point 209.216ºC

 Names

Name methyl 5-nitroisoquinoline-3-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.394g/cm3
Boiling Point 422.328ºC at 760 mmHg
Molecular Formula C11H8N2O4
Molecular Weight 232.19200
Flash Point 209.216ºC
Exact Mass 232.04800
PSA 85.01000
LogP 2.45280
Index of Refraction 1.647
InChIKey BYMILMIMXOKQBF-UHFFFAOYSA-N
SMILES COC(=O)c1cc2c([N+](=O)[O-])cccc2cn1

 Safety Information

HS Code 2933499090

 Synthetic Route

~96%

METHYL 5-NITRO-3-ISOQUINOLINECARBOXYLATE Structure

METHYL 5-NITRO-...

CAS#:581812-72-8

Literature: Abbott Laboratories Patent: US6933311 B2, 2005 ;

 Precursor & DownStream

Precursor  1

DownStream  0

 Customs

HS Code 2933499090
Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

methyl 5-nitro-3-isoquinolinecarboxylate
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