Cas no 57723-86-1 (1H-1,2,4-Triazole-3-acetonitrile, 5-(phenylmethyl)-)
57723-86-1 structure
Product Name:1H-1,2,4-Triazole-3-acetonitrile, 5-(phenylmethyl)-
CAS No:57723-86-1
MF:C11H10N4
MW:198.22390127182
CID:1606387
PubChem ID:386779
Update Time:2025-04-21
1H-1,2,4-Triazole-3-acetonitrile, 5-(phenylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-1,2,4-Triazole-3-acetonitrile, 5-(phenylmethyl)-
- (5-Benzyl-4H-[1,2,4]triazol-3-yl)-acetonitrile
- 2-(5-benzyl-1H-1,2,4-triazol-3-yl)acetonitrile
- AKOS013585972
- 57723-86-1
- SCHEMBL8832025
- (3-Benzyl-1H-1,2,4-triazol-5-yl)acetonitrile
- CHEMBL1981707
- NSC-679487
- DA-04723
- DTXSID10327715
- NSC679487
- NCI60_028417
- 2-(3-benzyl-1H-1,2,4-triazol-5-yl)acetonitrile
-
- Inchi： 1S/C11H10N4/c12-7-6-10-13-11(15-14-10)8-9-4-2-1-3-5-9/h1-5H,6,8H2,(H,13,14,15)
- InChI Key： HJLWPRWMFQIXJX-UHFFFAOYSA-N
- SMILES： N1C(CC2C=CC=CC=2)=NC(CC#N)=N1
Computed Properties
- Exact Mass: 198.0907
- Monoisotopic Mass: 198.090546336g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 238
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 65.4?2
Experimental Properties
- PSA: 65.36
1H-1,2,4-Triazole-3-acetonitrile, 5-(phenylmethyl)- Related Literature
-
Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
57723-86-1 (1H-1,2,4-Triazole-3-acetonitrile, 5-(phenylmethyl)-) Related Products
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
- 2034271-14-0(2-(1H-indol-3-yl)-N-{[6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide)
Recommended suppliers
Suzhou Genelee Bio-Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Changzhou Guanjia Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Zhangzhou Sinobioway Peptide Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
