Catalog No.:AA009V7A

118521-81-6 | 2-(2H-Benzo[d][1,2,3]triazol-2-yl)acetonitrile

Name: Name:2-(2H-Benzo[d][1,2,3]triazol-2-yl)acetonitrile
Brand: AABLOCKS
SKU: AA009V7A
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250mg

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Technical Information
Properties
Downstream Synthesis Route
Literature
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Technical Information
Properties
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA009V7A

Chemical Name:

2-(2H-Benzo[d][1,2,3]triazol-2-yl)acetonitrile

CAS Number:

118521-81-6

Molecular Formula:

C8H6N4

Molecular Weight:

158.1600

MDL Number:

MFCD01961343

SMILES:

N#CCn1nc2c(n1)cccc2

Properties

Computed Properties

Complexity:

192

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Rotatable Bond Count:

XLogP3:

1.7

Downstream Synthesis Route

67-56-1

118521-81-6

2-Benzotriazol-2-yl-acetimidicacidmethylester

[1]Danan;Charon;Kirkiacharian;Bories;Loiseau[IlFarmaco,1997,vol.52,#4,p.227-229]

95-14-7

107-14-2

111198-08-4

118521-81-6

[1]Carta,Antonio;Palomba,Michele;Boatto,Gianpiero;Busonera,Bernardetta;Murreddu,Marta;Loddo,Roberta[IlFarmaco,2004,vol.59,#8,p.637-644]

[2]Sanna,Paolo;Carta,Antonio;Nikookar,MohammadE.Rahbar[EuropeanJournalofMedicinalChemistry,2000,vol.35,#5,p.535-543]

[3]Danan;Charon;Kirkiacharian;Bories;Loiseau[IlFarmaco,1997,vol.52,#4,p.227-229]

[4]Das,Jagattaran;Rao,C.V.Laxman;Sastry;Roshaiah;Sankar,P.Gowri;Khadeer,Abdul;Kumar,M.Sitaram;Mallik,Arundhuti;Selvakumar;Iqbal,Javed;Trehan,Sanjay[BioorganicandMedicinalChemistryLetters,2005,vol.15,#2,p.337-343]

[5]Locationinpatent:experimentalpartYu,Tianzhi;Zhang,Peng;Zhao,Yuling;Zhang,Hui;Meng,Jing;Fan,Duowang;Chen,Lili;Qiu,Yongqing[Organicelectronics,2010,vol.11,#1,p.41-49]

[6]Li,Qiujing;Li,Zhulai;Liu,Guijun;Wang,Ningning;Yin,Huiyong[JournalofHeterocyclicChemistry,2019]

455-19-6

118521-81-6

(E)-2-Benzotriazol-2-yl-3-(4-trifluoromethyl-phenyl)-acrylonitrile

[1]Sanna,Paolo;Carta,Antonio;Nikookar,MohammadE.Rahbar[EuropeanJournalofMedicinalChemistry,2000,vol.35,#5,p.535-543]

104-87-0

118521-81-6

288072-07-1

[1]Sanna,Paolo;Carta,Antonio;Nikookar,MohammadE.Rahbar[EuropeanJournalofMedicinalChemistry,2000,vol.35,#5,p.535-543]

459-57-4

118521-81-6

(E)-2-Benzotriazol-2-yl-3-(4-fluoro-phenyl)-acrylonitrile

[1]Sanna,Paolo;Carta,Antonio;Nikookar,MohammadE.Rahbar[EuropeanJournalofMedicinalChemistry,2000,vol.35,#5,p.535-543]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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