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

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

CAS No.:
1221725-59-2
Catalog Number:
AG01A83K
Molecular Formula:
C9H10Cl2N4
Molecular Weight:
245.1085
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Product Description
Catalog Number:
AG01A83K
Chemical Name:
[1-(2-chlorophenyl)-1H-1,2,3-triazol-4-yl]methanamine hydrochloride
CAS Number:
1221725-59-2
Molecular Formula:
C9H10Cl2N4
Molecular Weight:
245.1085
MDL Number:
MFCD15209603
IUPAC Name:
[1-(2-chlorophenyl)triazol-4-yl]methanamine;hydrochloride
InChI:
InChI=1S/C9H9ClN4.ClH/c10-8-3-1-2-4-9(8)14-6-7(5-11)12-13-14;/h1-4,6H,5,11H2;1H
InChI Key:
XHYAJDUBPXSFNJ-UHFFFAOYSA-N
SMILES:
NCc1nnn(c1)c1ccccc1Cl.Cl
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.028g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.107g/mol
Monoisotopic Mass:
244.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties