AG00BU56

Name: 4-(1H-1,2,4-Triazol-1-yl)benzonitrile
Brand: Angene Chemical
SKU: AG00BU56

25699-89-2 | 4-(1H-1,2,4-Triazol-1-yl)benzonitrile

AG00BU56

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CAS Number	25699-89-2
Catalog Number	AG00BU56(AGN-PC-0N2DWJ)
Chemical Name	4-(1H-1,2,4-Triazol-1-yl)benzonitrile
IUPAC Name	4-(1,2,4-triazol-1-yl)benzonitrile
InChI	InChI=1S/C9H6N4/c10-5-8-1-3-9(4-2-8)13-7-11-6-12-13/h1-4,6-7H
InChI Key	GVHXOBQEQQQJEC-UHFFFAOYSA-N
MDL Number	MFCD07368643
Molecular Formula	C9H6N4
Molecular Weight	170.1707
SMILES	N#CC1=CC=C(C=C1)N1C=NC=N1
Synonyms	4-(1H-1,2,4-Triazol-1-yl)benzonitrile, 25699-89-2, SCHEMBL2270763, CTK8C2211, DTXSID90437982, GVHXOBQEQQQJEC-UHFFFAOYSA-N, 2126AB, ANW-68018, ZINC19867815, AKOS000222273, 4-[1,2,4]Triazol-1-yl-benzonitrile, AJ-75530, AS-40404, 4-(1H-1,2,4-Triazole-1-yl)benzonitrile, TC-156763, Benzonitrile, 4-(1H-1,2,4-triazol-1-yl)-, F8887-2126, C9H6N4, 4-(1,2,4-triazol-1-yl)benzonitrile, CID10313298, 4-(1H-1,2,4-Triazolylmethyl)benzonitrile, 112809-25-3,

Complexity	211
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.059g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	170.175g/mol
Monoisotopic Mass	170.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	54.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited