+1 858-523-8231
Login | Register
menu
AA Blocks, Building Blocks, Catalysts, Inhibitors
Login | Register
4314-19-6,MFCD00424275
Catalog No.:AA00DIZE

4314-19-6 | Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanethione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
90%
in stock  
$115.00   $80.00
- +
1g
90%
in stock  
$943.00   $660.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DIZE
Chemical Name:
Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanethione
CAS Number:
4314-19-6
Molecular Formula:
C13H8N6S
Molecular Weight:
280.3078
MDL Number:
MFCD00424275
SMILES:
S=C(n1nnc2c1cccc2)n1nnc2c1cccc2
Properties
Computed Properties
 
Complexity:
357  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.9  

Downstream Synthesis Route

[1]Katritzky,AlanR.;Ledoux,Stephane;Witek,RachelM.;Nair,SatheeshK.[JournalofOrganicChemistry,2004,vol.69,#9,p.2976-2982]

[1]Katritzky,AlanR.;Ledoux,Stephane;Witek,RachelM.;Nair,SatheeshK.[JournalofOrganicChemistry,2004,vol.69,#9,p.2976-2982]

[1]Katritzky,AlanR.;Ledoux,Stephane;Witek,RachelM.;Nair,SatheeshK.[JournalofOrganicChemistry,2004,vol.69,#9,p.2976-2982]

[2]Katritzky,AlanR.;Witek,RachelM.;Rodriguez-Garcia,Valerie;Mohapatra,PrabhuP.;Rogers,JamesW.;Cusido,Janet;Abdel-Fattah,AshrafA.A.;Steel,PeterJ.[JournalofOrganicChemistry,2005,vol.70,#20,p.7866-7881]

[1]Katritzky,AlanR.;Ledoux,Stephane;Witek,RachelM.;Nair,SatheeshK.[JournalofOrganicChemistry,2004,vol.69,#9,p.2976-2982]

[2]Locationinpatent:experimentalpartKatritzky,AlanR.;Meher,Geeta;Narindoshvili,Tamari[CollectionofCzechoslovakChemicalCommunications,2009,vol.74,#7-8,p.1061-1068]

[1]Synlett,2010,p.715-720

[2]Chemistry-AEuropeanJournal,2015,vol.21,p.2870-2880

Literature

Title: 1-(Alkyl/arylthiocarbamoyl)benzotriazoles as stable isothiocyanate equivalents: synthesis of Di- and trisubstituted thioureas.

Journal: The Journal of organic chemistry 20040430

Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
Submit
SDS
Related Products of 4314-19-6
88064-00-0

88064-00-0

 88088-95-3

88088-95-3

 50339-35-0

50339-35-0
Building Blocks
More >
Historical Records
38806-09-6

38806-09-6

 941978-40-1

941978-40-1

 1401556-46-4

1401556-46-4

 1314782-43-8

1314782-43-8
Tags:4314-19-6 Molecular Formula|4314-19-6 MDL|4314-19-6 SMILES|4314-19-6 Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanethione
Catalog No.: AA00DIZE
4314-19-6,MFCD00424275
4314-19-6 | Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanethione
Pack Size： 100mg
Purity： 90%
in stock
$115.00 $80.00
Pack Size： 1g
Purity： 90%
in stock
$943.00 $660.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DIZE
Chemical Name: Bis(1H-benzo[d][1,2,3]triazol-1-yl)methanethione
CAS Number: 4314-19-6
Molecular Formula: C13H8N6S
Molecular Weight: 280.3078
MDL Number: MFCD00424275
SMILES: S=C(n1nnc2c1cccc2)n1nnc2c1cccc2
Properties
Complexity: 357  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 20  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.9  
Downstream Synthesis Route
96-50-4    4314-19-6    690634-07-2 

[1]Katritzky,AlanR.;Ledoux,Stephane;Witek,RachelM.;Nair,SatheeshK.[JournalofOrganicChemistry,2004,vol.69,#9,p.2976-2982]

109-55-7    62-53-3    4314-19-6    722-04-3 

[1]Katritzky,AlanR.;Ledoux,Stephane;Witek,RachelM.;Nair,SatheeshK.[JournalofOrganicChemistry,2004,vol.69,#9,p.2976-2982]

543-82-8    4314-19-6    690634-05-0 

[1]Katritzky,AlanR.;Ledoux,Stephane;Witek,RachelM.;Nair,SatheeshK.[JournalofOrganicChemistry,2004,vol.69,#9,p.2976-2982]

[2]Katritzky,AlanR.;Witek,RachelM.;Rodriguez-Garcia,Valerie;Mohapatra,PrabhuP.;Rogers,JamesW.;Cusido,Janet;Abdel-Fattah,AshrafA.A.;Steel,PeterJ.[JournalofOrganicChemistry,2005,vol.70,#20,p.7866-7881]

4314-19-6    107-11-9    690634-06-1 

[1]Katritzky,AlanR.;Ledoux,Stephane;Witek,RachelM.;Nair,SatheeshK.[JournalofOrganicChemistry,2004,vol.69,#9,p.2976-2982]

[2]Locationinpatent:experimentalpartKatritzky,AlanR.;Meher,Geeta;Narindoshvili,Tamari[CollectionofCzechoslovakChemicalCommunications,2009,vol.74,#7-8,p.1061-1068]

4314-19-6    146552-72-9    1228754-05-9 

[1]Synlett,2010,p.715-720

[2]Chemistry-AEuropeanJournal,2015,vol.21,p.2870-2880

Literature fold

Title: 1-(Alkyl/arylthiocarbamoyl)benzotriazoles as stable isothiocyanate equivalents: synthesis of Di- and trisubstituted thioureas.

Journal: The Journal of organic chemistry20040430

Related Products of of 4314-19-6
88064-00-0
88064-00-0
88088-95-3
88088-95-3
50339-35-0
50339-35-0
Building Blocks More >
55805-14-6
55805-14-6
4-(1,1-Difluoroethyl)benzoic acid
AA00DJFA | MFCD20643344
52798-09-1
52798-09-1
2-(4-Carbamimidoylphenyl)acetic acid hydrochloride
AA00DJNS | MFCD11505975
54147-45-4
54147-45-4
1-CHLORO-3-METHYLPENTAN-2-ONE
AA00DJXX | MFCD19232336
556112-19-7
556112-19-7
Benzene, 1,2-dichloro-3-ethynyl-
AA00DK80 | MFCD16616293
550370-15-5
550370-15-5
3-Phenylazetidin-3-ol hydrochloride
AA00DKFM | MFCD22570262
4492-50-6
4492-50-6
N-Methylcyclopentanecarboxamide
AA00DKJD | MFCD10665903
4691-72-9
4691-72-9
ethyl 2-broMo-2-(4-nitrophenyl)acetate
AA00DKTS | MFCD12756034
50470-12-7
50470-12-7
Pyridine, 2-chloro-3-isothiocyanato-
AA00DL4K | MFCD16622108
477312-25-7
477312-25-7
1-(3-(Trifluoromethoxy)phenyl)ethanamine
AA00DLFT | MFCD16617621
442644-28-2
442644-28-2
Trispiro[3H-indole-3,2′-[1,3]dioxane-5′,5′′-[1,3]dioxane-2′′,3′′′-[3H]indole]-2,2′′′(1H,1′′′H)-dione (9CI)
AA00DLTD | MFCD03036757
Historical Records
38806-09-6
38806-09-6
941978-40-1
941978-40-1
1401556-46-4
1401556-46-4
1314782-43-8
1314782-43-8
Submit
© 2017 AA BLOCKS, INC. All rights reserved.