Home Other Building Blocks [3-(trifluoromethyl)cyclohexyl]methanamine

[3-(trifluoromethyl)cyclohexyl]methanamine

CAS No.:
832753-69-2
Catalog Number:
AG019YQF
Molecular Formula:
C8H14F3N
Molecular Weight:
181.1987
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Product Description
Catalog Number:
AG019YQF
Chemical Name:
[3-(trifluoromethyl)cyclohexyl]methanamine
CAS Number:
832753-69-2
Molecular Formula:
C8H14F3N
Molecular Weight:
181.1987
MDL Number:
MFCD04973003
IUPAC Name:
[3-(trifluoromethyl)cyclohexyl]methanamine
InChI:
InChI=1S/C8H14F3N/c9-8(10,11)7-3-1-2-6(4-7)5-12/h6-7H,1-5,12H2
InChI Key:
WCQDDUFZBFJYIO-UHFFFAOYSA-N
SMILES:
NCC1CCCC(C1)C(F)(F)F
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.108g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.202g/mol
Monoisotopic Mass:
181.108g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties