Home Other Building Blocks N-(2-methylpropyl)-3-(trifluoromethyl)aniline hydrochloride

N-(2-methylpropyl)-3-(trifluoromethyl)aniline hydrochloride

CAS No.:
1909347-96-1
Catalog Number:
AG01C4PB
Molecular Formula:
C11H15ClF3N
Molecular Weight:
253.6917
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Product Description
Catalog Number:
AG01C4PB
Chemical Name:
N-(2-methylpropyl)-3-(trifluoromethyl)aniline hydrochloride
CAS Number:
1909347-96-1
Molecular Formula:
C11H15ClF3N
Molecular Weight:
253.6917
MDL Number:
MFCD29906961
IUPAC Name:
N-(2-methylpropyl)-3-(trifluoromethyl)aniline;hydrochloride
InChI:
InChI=1S/C11H14F3N.ClH/c1-8(2)7-15-10-5-3-4-9(6-10)11(12,13)14;/h3-6,8,15H,7H2,1-2H3;1H
InChI Key:
NHIGUSYVEHJYHW-UHFFFAOYSA-N
SMILES:
CC(CNc1cccc(c1)C(F)(F)F)C.Cl
Properties
Complexity:
189  
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:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties