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Home Aminos 3-(dimethylamino)-1-[4-(trifluoromethyl)phenyl]propan-1-one hydrochloride

3-(dimethylamino)-1-[4-(trifluoromethyl)phenyl]propan-1-one hydrochloride

CAS No.:
634924-02-0
Catalog Number:
AG01BXN7
Molecular Formula:
C12H15ClF3NO
Molecular Weight:
281.7018
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Product Description
Catalog Number:
AG01BXN7
Chemical Name:
3-(dimethylamino)-1-[4-(trifluoromethyl)phenyl]propan-1-one hydrochloride
CAS Number:
634924-02-0
Molecular Formula:
C12H15ClF3NO
Molecular Weight:
281.7018
MDL Number:
MFCD30487884
IUPAC Name:
3-(dimethylamino)-1-[4-(trifluoromethyl)phenyl]propan-1-one;hydrochloride
InChI:
InChI=1S/C12H14F3NO.ClH/c1-16(2)8-7-11(17)9-3-5-10(6-4-9)12(13,14)15;/h3-6H,7-8H2,1-2H3;1H
InChI Key:
IWTUUIBSAWCLOU-UHFFFAOYSA-N
SMILES:
CN(CCC(=O)c1ccc(cc1)C(F)(F)F)C.Cl
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.079g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.703g/mol
Monoisotopic Mass:
281.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties