5-Nitroisoquinoline

Modify Date: 2025-09-04 08:20:41

5-Nitroisoquinoline Structure
5-Nitroisoquinoline structure
Common Name 5-Nitroisoquinoline
CAS Number 607-32-9 Molecular Weight 174.156
Density 1.4±0.1 g/cm3 Boiling Point 340.5±17.0 °C at 760 mmHg
Molecular Formula C9H6N2O2 Melting Point 106-109 °C(lit.)
MSDS N/A Flash Point 159.7±20.9 °C

 Names

Name 5-Nitroisoquinoline
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 340.5±17.0 °C at 760 mmHg
Melting Point 106-109 °C(lit.)
Molecular Formula C9H6N2O2
Molecular Weight 174.156
Flash Point 159.7±20.9 °C
Exact Mass 174.042923
PSA 58.71000
LogP 1.69
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.682
InChIKey PYGMPFQCCWBTJQ-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1cccc2cnccc12

 Safety Information

Hazard Codes Xn:Harmful;
Risk Phrases R20/21/22;R38
Safety Phrases S26-S37/39-S36/37/39
WGK Germany 3
HS Code 2933499090

 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%

 5-NitroisoquinolineBioassay

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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
Name: uHTS identification of small molecule modulators of NR3A
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1015-NR3A-Primary-Assay
Name: uHTS identification of small molecule modulators of Rev-erb Alpha.
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1016-RevErbaLBD-Primary-Assay
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 Synonyms

5-Nitroisoquinoline
Isoquinoline,5-nitro
EINECS 210-133-8
MFCD00006905
5-NO2-isoquinoline
5-nitro isoquinoline
5-nitroisochinolin
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