73458-39-6,MFCD00160073
Catalog No.:AA003MUD

73458-39-6 | 2-Amino-5-nitrobenzothiazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$19.00   $13.00
- +
1g
95%
in stock  
$49.00   $34.00
- +
5g
95%
in stock  
$200.00   $140.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003MUD
Chemical Name:
2-Amino-5-nitrobenzothiazole
CAS Number:
73458-39-6
Molecular Formula:
C7H5N3O2S
Molecular Weight:
195.1985
MDL Number:
MFCD00160073
SMILES:
Nc1sc2c(n1)cc(cc2)[N+](=O)[O-]
Properties
Properties
 
Form:
Solid  
MP:
308-309℃ (decomp)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
220  
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:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.1  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,#9,p.2540-2544

Downstream Synthesis Route
769-42-6    73458-39-6   
1,3-Dimethyl-5-(5-nitro-benzothiazol-2-yl)-hydrazono-pyrimidine-2,4,6-trione 

[1]IndianJournalofChemistry,SectionA:Inorganic,Physical,TheoreticalandAnalytical,1982,vol.21,p.114-117

[1]ZeitschriftfurChemie,1980,vol.20,p.436-437

[2]Patent:US4808723,1989,A

[1]JournalofChemicalandEngineeringData,1986,vol.31,p.501-502

[2]EuropeanJournalofMedicinalChemistry,2010,vol.45,p.1323-1331

[3]LettersinOrganicChemistry,2020,vol.17,p.141-148

99-93-4    73458-39-6   
4-{1-(Z)-5-Nitro-benzothiazol-2-ylimino-ethyl}-phenol 

[1]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2005,vol.44,p.1859-1862

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.2540-2544

Literature
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SDS
Tags:73458-39-6 Molecular Formula|73458-39-6 MDL|73458-39-6 SMILES|73458-39-6 2-Amino-5-nitrobenzothiazole
Catalog No.: AA003MUD
73458-39-6,MFCD00160073
73458-39-6 | 2-Amino-5-nitrobenzothiazole
Pack Size: 250mg
Purity: 95%
in stock
$19.00 $13.00
Pack Size: 1g
Purity: 95%
in stock
$49.00 $34.00
Pack Size: 5g
Purity: 95%
in stock
$200.00 $140.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003MUD
Chemical Name: 2-Amino-5-nitrobenzothiazole
CAS Number: 73458-39-6
Molecular Formula: C7H5N3O2S
Molecular Weight: 195.1985
MDL Number: MFCD00160073
SMILES: Nc1sc2c(n1)cc(cc2)[N+](=O)[O-]
Properties
Form: Solid  
MP: 308-309℃ (decomp)  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 220  
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: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.1  
Upstream Synthesis Route
73458-39-6    3622-38-6 

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,#9,p.2540-2544

Downstream Synthesis Route
769-42-6    73458-39-6   
1,3-Dimethyl-5-(5-nitro-benzothiazol-2-yl)-hydrazono-pyrimidine-2,4,6-trione 

[1]IndianJournalofChemistry,SectionA:Inorganic,Physical,TheoreticalandAnalytical,1982,vol.21,p.114-117

1594-56-5    73458-39-6 

[1]ZeitschriftfurChemie,1980,vol.20,p.436-437

[2]Patent:US4808723,1989,A

709-72-8    73458-39-6 

[1]JournalofChemicalandEngineeringData,1986,vol.31,p.501-502

[2]EuropeanJournalofMedicinalChemistry,2010,vol.45,p.1323-1331

[3]LettersinOrganicChemistry,2020,vol.17,p.141-148

99-93-4    73458-39-6   
4-{1-(Z)-5-Nitro-benzothiazol-2-ylimino-ethyl}-phenol 

[1]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2005,vol.44,p.1859-1862

73458-39-6    80945-80-8 

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.2540-2544

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