Home Halogens 1-[4-(4-chlorophenyl)-5-methyl-1H-imidazol-2-yl]ethan-1-amine dihydrochloride

1-[4-(4-chlorophenyl)-5-methyl-1H-imidazol-2-yl]ethan-1-amine dihydrochloride

CAS No.:
1421602-15-4
Catalog Number:
AG01A18Q
Molecular Formula:
C12H16Cl3N3
Molecular Weight:
308.6345
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Product Description
Catalog Number:
AG01A18Q
Chemical Name:
1-[4-(4-chlorophenyl)-5-methyl-1H-imidazol-2-yl]ethan-1-amine dihydrochloride
CAS Number:
1421602-15-4
Molecular Formula:
C12H16Cl3N3
Molecular Weight:
308.6345
MDL Number:
MFCD22392216
IUPAC Name:
1-[4-(4-chlorophenyl)-5-methyl-1H-imidazol-2-yl]ethanamine;dihydrochloride
InChI:
InChI=1S/C12H14ClN3.2ClH/c1-7(14)12-15-8(2)11(16-12)9-3-5-10(13)6-4-9;;/h3-7H,14H2,1-2H3,(H,15,16);2*1H
InChI Key:
VKXXMBCZRGSHDN-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nc([nH]c1C)C(N)C.Cl.Cl
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.041g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
308.631g/mol
Monoisotopic Mass:
307.041g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties