Home Nitros 4-Hydroxy-1-(2-nitro-5-trifluoromethylphenyl)piperidine

4-Hydroxy-1-(2-nitro-5-trifluoromethylphenyl)piperidine

CAS No.:
1072944-51-4
Catalog Number:
AG0090FA
Molecular Formula:
C12H13F3N2O3
Molecular Weight:
290.2384
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$163
- +
5g
98%
In Stock USA
United States
$650
- +
Product Description
Catalog Number:
AG0090FA
Chemical Name:
4-Hydroxy-1-(2-nitro-5-trifluoromethylphenyl)piperidine
CAS Number:
1072944-51-4
Molecular Formula:
C12H13F3N2O3
Molecular Weight:
290.2384
MDL Number:
MFCD11504892
IUPAC Name:
1-[2-nitro-5-(trifluoromethyl)phenyl]piperidin-4-ol
InChI:
InChI=1S/C12H13F3N2O3/c13-12(14,15)8-1-2-10(17(19)20)11(7-8)16-5-3-9(18)4-6-16/h1-2,7,9,18H,3-6H2
InChI Key:
ILFAFEMBDFFPRR-UHFFFAOYSA-N
SMILES:
OC1CCN(CC1)c1cc(ccc1[N+](=O)[O-])C(F)(F)F
Properties
Complexity:
351  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.088g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
290.242g/mol
Monoisotopic Mass:
290.088g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties