Home Other Building Blocks 1-(2-Chloroethyl)-3,5-dimethyl-1H-1,2,4-triazole hydrochloride

1-(2-Chloroethyl)-3,5-dimethyl-1H-1,2,4-triazole hydrochloride

CAS No.:
53946-19-3
Catalog Number:
AG019T35
Molecular Formula:
C6H11Cl2N3
Molecular Weight:
196.0776
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Product Description
Catalog Number:
AG019T35
Chemical Name:
1-(2-Chloroethyl)-3,5-dimethyl-1H-1,2,4-triazole hydrochloride
CAS Number:
53946-19-3
Molecular Formula:
C6H11Cl2N3
Molecular Weight:
196.0776
MDL Number:
MFCD22056462
IUPAC Name:
1-(2-chloroethyl)-3,5-dimethyl-1,2,4-triazole;hydrochloride
InChI:
InChI=1S/C6H10ClN3.ClH/c1-5-8-6(2)10(9-5)4-3-7;/h3-4H2,1-2H3;1H
InChI Key:
WAVYJTMHQCRXGS-UHFFFAOYSA-N
SMILES:
Cc1nc(nn1CCCl)C.Cl
Properties
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.033g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.075g/mol
Monoisotopic Mass:
195.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties