Home Halogens {2-[(4-chlorophenyl)methyl]-1,3-thiazol-4-yl}methanamine dihydrochloride

{2-[(4-chlorophenyl)methyl]-1,3-thiazol-4-yl}methanamine dihydrochloride

CAS No.:
1989672-64-1
Catalog Number:
AG01B6CI
Molecular Formula:
C11H13Cl3N2S
Molecular Weight:
311.6583
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Product Description
Catalog Number:
AG01B6CI
Chemical Name:
{2-[(4-chlorophenyl)methyl]-1,3-thiazol-4-yl}methanamine dihydrochloride
CAS Number:
1989672-64-1
Molecular Formula:
C11H13Cl3N2S
Molecular Weight:
311.6583
MDL Number:
MFCD30342802
IUPAC Name:
[2-[(4-chlorophenyl)methyl]-1,3-thiazol-4-yl]methanamine;dihydrochloride
InChI:
InChI=1S/C11H11ClN2S.2ClH/c12-9-3-1-8(2-4-9)5-11-14-10(6-13)7-15-11;;/h1-4,7H,5-6,13H2;2*1H
InChI Key:
TULCEYURLYXFSZ-UHFFFAOYSA-N
SMILES:
NCc1csc(n1)Cc1ccc(cc1)Cl.Cl.Cl
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.987g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
311.649g/mol
Monoisotopic Mass:
309.987g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties