Home Halogens [3-(4-bromophenyl)-1H-1,2,4-triazol-5-yl]methanamine hydrochloride

[3-(4-bromophenyl)-1H-1,2,4-triazol-5-yl]methanamine hydrochloride

CAS No.:
1240527-78-9
Catalog Number:
AG01A9I8
Molecular Formula:
C9H10BrClN4
Molecular Weight:
289.5595
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Product Description
Catalog Number:
AG01A9I8
Chemical Name:
[3-(4-bromophenyl)-1H-1,2,4-triazol-5-yl]methanamine hydrochloride
CAS Number:
1240527-78-9
Molecular Formula:
C9H10BrClN4
Molecular Weight:
289.5595
MDL Number:
MFCD16622093
IUPAC Name:
[3-(4-bromophenyl)-1H-1,2,4-triazol-5-yl]methanamine;hydrochloride
InChI:
InChI=1S/C9H9BrN4.ClH/c10-7-3-1-6(2-4-7)9-12-8(5-11)13-14-9;/h1-4H,5,11H2,(H,12,13,14);1H
InChI Key:
NGCSVHKYOODXAM-UHFFFAOYSA-N
SMILES:
NCc1[nH]nc(n1)c1ccc(cc1)Br.Cl
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.978g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
289.561g/mol
Monoisotopic Mass:
287.978g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties