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Home Halogens {[1-(3-chlorophenyl)-1H-pyrazol-4-yl]methyl}(methyl)amine hydrochloride

{[1-(3-chlorophenyl)-1H-pyrazol-4-yl]methyl}(methyl)amine hydrochloride

CAS No.:
1208518-95-9
Catalog Number:
AG019XFV
Molecular Formula:
C11H13Cl2N3
Molecular Weight:
258.1470
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Product Description
Catalog Number:
AG019XFV
Chemical Name:
{[1-(3-chlorophenyl)-1H-pyrazol-4-yl]methyl}(methyl)amine hydrochloride
CAS Number:
1208518-95-9
Molecular Formula:
C11H13Cl2N3
Molecular Weight:
258.1470
MDL Number:
MFCD13196149
IUPAC Name:
1-[1-(3-chlorophenyl)pyrazol-4-yl]-N-methylmethanamine;hydrochloride
InChI:
InChI=1S/C11H12ClN3.ClH/c1-13-6-9-7-14-15(8-9)11-4-2-3-10(12)5-11;/h2-5,7-8,13H,6H2,1H3;1H
InChI Key:
STVYCLWJVFVVEB-UHFFFAOYSA-N
SMILES:
CNCc1cnn(c1)c1cccc(c1)Cl.Cl
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.049g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.146g/mol
Monoisotopic Mass:
257.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties