Home Other Building Blocks 2-(3-Trifluoromethylphenoxy)methylpiperidine

2-(3-Trifluoromethylphenoxy)methylpiperidine

CAS No.:
1019443-66-3
Catalog Number:
AG000613
Molecular Formula:
C13H16F3NO
Molecular Weight:
259.2674
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$100
- +
5g
96%
In Stock USA
United States
$300
- +
10g
96%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG000613
Chemical Name:
2-(3-Trifluoromethylphenoxy)methylpiperidine
CAS Number:
1019443-66-3
Molecular Formula:
C13H16F3NO
Molecular Weight:
259.2674
MDL Number:
MFCD13272699
IUPAC Name:
2-[[3-(trifluoromethyl)phenoxy]methyl]piperidine
InChI:
InChI=1S/C13H16F3NO/c14-13(15,16)10-4-3-6-12(8-10)18-9-11-5-1-2-7-17-11/h3-4,6,8,11,17H,1-2,5,7,9H2
InChI Key:
WMPHKVGGCCEZHM-UHFFFAOYSA-N
SMILES:
FC(c1cccc(c1)OCC1CCCCN1)(F)F
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.118g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.272g/mol
Monoisotopic Mass:
259.118g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties