607-32-9,MFCD00006905
Catalog No.:AA003MUN

607-32-9 | 5-Nitroisoquinoline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$7.00   $5.00
- +
10g
98%
in stock  
$11.00   $8.00
- +
25g
98%
in stock  
$22.00   $16.00
- +
100g
98%
in stock  
$65.00   $46.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003MUN
Chemical Name:
5-Nitroisoquinoline
CAS Number:
607-32-9
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
MDL Number:
MFCD00006905
SMILES:
[O-][N+](=O)c1cccc2c1ccnc2
NSC Number:
3017
Properties
Properties
 
BP:
340.5 °C at 760 mmHg  
Form:
Solid  
MP:
106-109 °C(lit.)  
Refractive Index:
1.5651 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
202  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.9  

Literature

Title: Experimental and theoretical quantum chemical investigations of 8-hydroxy-5-nitroquinoline.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20121001

Title: Selective ortho methylation of nitroheteroaryls by vicarious nucleophilic substitution.

Journal: The Journal of organic chemistry 20080905

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Implication of nitro group reduction in the mutagenic and chromosome damaging activities of 22 new 5-nitroisoquinolines by the Salmonella mutagenicity test and the cytokinesis-blocked micronucleus assay.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20030201

Title: An expeditious synthesis of cytotoxic pyrroloisoquinoline derivatives. Structure-activity comparative studies with isomeric pyrroloquinolines.

Journal: European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences 20021101

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Additional Info:
SDS
Historical Records
Tags:607-32-9 Molecular Formula|607-32-9 MDL|607-32-9 SMILES|607-32-9 5-Nitroisoquinoline
Catalog No.: AA003MUN
607-32-9,MFCD00006905
607-32-9 | 5-Nitroisoquinoline
Pack Size: 5g
Purity: 98%
in stock
$7.00 $5.00
Pack Size: 10g
Purity: 98%
in stock
$11.00 $8.00
Pack Size: 25g
Purity: 98%
in stock
$22.00 $16.00
Pack Size: 100g
Purity: 98%
in stock
$65.00 $46.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003MUN
Chemical Name: 5-Nitroisoquinoline
CAS Number: 607-32-9
Molecular Formula: C9H6N2O2
Molecular Weight: 174.1561
MDL Number: MFCD00006905
SMILES: [O-][N+](=O)c1cccc2c1ccnc2
NSC Number: 3017
Properties
BP: 340.5 °C at 760 mmHg  
Form: Solid  
MP: 106-109 °C(lit.)  
Refractive Index: 1.5651 (estimate)  
Storage: Keep in dry area;Room Temperature;  
Complexity: 202  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.9  
Literature fold

Title: Experimental and theoretical quantum chemical investigations of 8-hydroxy-5-nitroquinoline.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy20121001

Title: Selective ortho methylation of nitroheteroaryls by vicarious nucleophilic substitution.

Journal: The Journal of organic chemistry20080905

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology20060501

Title: Implication of nitro group reduction in the mutagenic and chromosome damaging activities of 22 new 5-nitroisoquinolines by the Salmonella mutagenicity test and the cytokinesis-blocked micronucleus assay.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association20030201

Title: An expeditious synthesis of cytotoxic pyrroloisoquinoline derivatives. Structure-activity comparative studies with isomeric pyrroloquinolines.

Journal: European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences20021101

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