Home Other Building Blocks 1-[3-(trifluoromethyl)phenyl]butan-1-amine

1-[3-(trifluoromethyl)phenyl]butan-1-amine

CAS No.:
708253-40-1
Catalog Number:
AG01A9J6
Molecular Formula:
C11H14F3N
Molecular Weight:
217.2308
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Product Description
Catalog Number:
AG01A9J6
Chemical Name:
1-[3-(trifluoromethyl)phenyl]butan-1-amine
CAS Number:
708253-40-1
Molecular Formula:
C11H14F3N
Molecular Weight:
217.2308
MDL Number:
MFCD11148427
IUPAC Name:
1-[3-(trifluoromethyl)phenyl]butan-1-amine
InChI:
InChI=1S/C11H14F3N/c1-2-4-10(15)8-5-3-6-9(7-8)11(12,13)14/h3,5-7,10H,2,4,15H2,1H3
InChI Key:
ZVSDXABGZDMDIE-UHFFFAOYSA-N
SMILES:
CCCC(c1cccc(c1)C(F)(F)F)N
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.108g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.235g/mol
Monoisotopic Mass:
217.108g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties