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216002-20-9 | (R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethanamine hydrochloride
CAS No: 216002-20-9 Catalog No: AG003C7E MDL No:MFCD03426128
Product Description
Catalog Number:
AG003C7E
Chemical Name:
(R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethanamine hydrochloride
CAS Number:
216002-20-9
Molecular Formula:
C10H10ClF6N
Molecular Weight:
293.6365
MDL Number:
MFCD03426128
IUPAC Name:
(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethanamine;hydrochloride
InChI:
InChI=1S/C10H9F6N.ClH/c1-5(17)6-2-7(9(11,12)13)4-8(3-6)10(14,15)16;/h2-5H,17H2,1H3;1H/t5-;/m1./s1
InChI Key:
DWSPCWWXKNPRFN-NUBCRITNSA-N
SMILES:
C[C@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)N.Cl
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
293.041g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
293.637g/mol
Monoisotopic Mass:
293.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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