Home Other Building Blocks 2-Pentanamine, 1,1,1-trifluoro-4-methyl-

2-Pentanamine, 1,1,1-trifluoro-4-methyl-

CAS No.:
686-91-9
Catalog Number:
AG00FTIR
Molecular Formula:
C6H12F3N
Molecular Weight:
155.1614
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Product Description
Catalog Number:
AG00FTIR
Chemical Name:
2-Pentanamine, 1,1,1-trifluoro-4-methyl-
CAS Number:
686-91-9
Molecular Formula:
C6H12F3N
Molecular Weight:
155.1614
MDL Number:
MFCD16817680
IUPAC Name:
1,1,1-trifluoro-4-methylpentan-2-amine
InChI:
InChI=1S/C6H12F3N/c1-4(2)3-5(10)6(7,8)9/h4-5H,3,10H2,1-2H3
InChI Key:
GAIOQBNXIHMNHE-UHFFFAOYSA-N
SMILES:
NC(C(F)(F)F)CC(C)C
Properties
Complexity:
97.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.092g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
155.164g/mol
Monoisotopic Mass:
155.092g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties