Name: Name:5-(4-bromophenyl)-N-methyl-4H-1,2,4-triazol-3-amine
Brand: Angene
SKU: AG01C4ZE
Rating: 90 (10 reviews)

5-(4-bromophenyl)-N-methyl-4H-1,2,4-triazol-3-amine

CAS No.:

1909327-56-5

Catalog Number:

AG01C4ZE

Molecular Formula:

C9H9BrN4

Molecular Weight:

253.0986

Catalog Number:

AG01C4ZE

Chemical Name:

5-(4-bromophenyl)-N-methyl-4H-1,2,4-triazol-3-amine

CAS Number:

1909327-56-5

Molecular Formula:

C9H9BrN4

Molecular Weight:

253.0986

MDL Number:

MFCD29907038

IUPAC Name:

5-(4-bromophenyl)-N-methyl-1H-1,2,4-triazol-3-amine

InChI:

InChI=1S/C9H9BrN4/c1-11-9-12-8(13-14-9)6-2-4-7(10)5-3-6/h2-5H,1H3,(H2,11,12,13,14)

InChI Key:

GWQWPZWYJWFRMP-UHFFFAOYSA-N

SMILES:

CNc1nnc([nH]1)c1ccc(cc1)Br

Complexity:

182

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

252.001g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.103g/mol

Monoisotopic Mass:

252.001g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7