Home Other Building Blocks 1-[2-(trifluoromethyl)phenyl]butan-2-amine hydrochloride

1-[2-(trifluoromethyl)phenyl]butan-2-amine hydrochloride

CAS No.:
1354962-67-6
Catalog Number:
AG019T7O
Molecular Formula:
C11H15ClF3N
Molecular Weight:
253.6917
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Product Description
Catalog Number:
AG019T7O
Chemical Name:
1-[2-(trifluoromethyl)phenyl]butan-2-amine hydrochloride
CAS Number:
1354962-67-6
Molecular Formula:
C11H15ClF3N
Molecular Weight:
253.6917
MDL Number:
MFCD08450597
IUPAC Name:
1-[2-(trifluoromethyl)phenyl]butan-2-amine;hydrochloride
InChI:
InChI=1S/C11H14F3N.ClH/c1-2-9(15)7-8-5-3-4-6-10(8)11(12,13)14;/h3-6,9H,2,7,15H2,1H3;1H
InChI Key:
YPQOZMMHLBABOR-UHFFFAOYSA-N
SMILES:
CCC(Cc1ccccc1C(F)(F)F)N.Cl
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.693g/mol
Monoisotopic Mass:
253.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties