Home Other Building Blocks 3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]butan-2-amine hydrochloride

3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]butan-2-amine hydrochloride

CAS No.:
1803584-22-6
Catalog Number:
AG01BCEV
Molecular Formula:
C13H19ClF3N
Molecular Weight:
281.7449
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Product Description
Catalog Number:
AG01BCEV
Chemical Name:
3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]butan-2-amine hydrochloride
CAS Number:
1803584-22-6
Molecular Formula:
C13H19ClF3N
Molecular Weight:
281.7449
MDL Number:
MFCD28714795
IUPAC Name:
3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]butan-2-amine;hydrochloride
InChI:
InChI=1S/C13H18F3N.ClH/c1-12(2,3)11(17)8-9-6-4-5-7-10(9)13(14,15)16;/h4-7,11H,8,17H2,1-3H3;1H
InChI Key:
QBKLVJMCDPKNRN-UHFFFAOYSA-N
SMILES:
NC(C(C)(C)C)Cc1ccccc1C(F)(F)F.Cl
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.116g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
281.747g/mol
Monoisotopic Mass:
281.116g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties