Home Other Building Blocks 1-{5-[4-(trifluoromethyl)phenyl]thiophen-2-yl}ethan-1-amine hydrochloride

1-{5-[4-(trifluoromethyl)phenyl]thiophen-2-yl}ethan-1-amine hydrochloride

CAS No.:
1803605-88-0
Catalog Number:
AG01BDD7
Molecular Formula:
C13H13ClF3NS
Molecular Weight:
307.7622
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Product Description
Catalog Number:
AG01BDD7
Chemical Name:
1-{5-[4-(trifluoromethyl)phenyl]thiophen-2-yl}ethan-1-amine hydrochloride
CAS Number:
1803605-88-0
Molecular Formula:
C13H13ClF3NS
Molecular Weight:
307.7622
MDL Number:
MFCD28023603
IUPAC Name:
1-[5-[4-(trifluoromethyl)phenyl]thiophen-2-yl]ethanamine;hydrochloride
InChI:
InChI=1S/C13H12F3NS.ClH/c1-8(17)11-6-7-12(18-11)9-2-4-10(5-3-9)13(14,15)16;/h2-8H,17H2,1H3;1H
InChI Key:
CEHNCGCLFFYOMS-UHFFFAOYSA-N
SMILES:
CC(c1ccc(s1)c1ccc(cc1)C(F)(F)F)N.Cl
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.041g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
307.759g/mol
Monoisotopic Mass:
307.041g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties