AG01E7TR

Name: 5-(3-bromophenyl)-1H-1,2,4-triazole-3-carbonitrile
Brand: Angene Chemical
SKU: AG01E7TR

328281-85-2 | 5-(3-bromophenyl)-1H-1,2,4-triazole-3-carbonitrile

AG01E7TR

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CAS Number	328281-85-2
Catalog Number	AG01E7TR
Chemical Name	5-(3-bromophenyl)-1H-1,2,4-triazole-3-carbonitrile
IUPAC Name	5-(3-bromophenyl)-1H-1,2,4-triazole-3-carbonitrile
InChI	InChI=1S/C9H5BrN4/c10-7-3-1-2-6(4-7)9-12-8(5-11)13-14-9/h1-4H,(H,12,13,14)
InChI Key	QELMUXYSPFQBAE-UHFFFAOYSA-N
MDL Number	MFCD01789804
Molecular Formula	C9H5BrN4
Molecular Weight	249.0668
SMILES	BrC1=CC(C2NN=C(C#N)N=2)=CC=C1
Synonyms	5-(3-bromophenyl)-1H-1,2,4-triazole-3-carbonitrile, 328281-85-2, AC1LEA92, ZINC48819, 1H-1,2,4-Triazole-5-carbonitrile, 3-(3-bromophenyl)-, AKOS024274719, FCH2311838, MCULE-3427455719, ST006875, EN300-203724, Z2027049468, CID682928, ZINC00048819,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247.97g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	249.071g/mol
Monoisotopic Mass	247.97g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	65.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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