200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 702650-29-1
702650-29-1 | 1-(4-(trifluoromethyl)-2-nitrophenyl)piperidin-4-ol
CAS No: 702650-29-1 Catalog No: AG01EX15 MDL No:
Product Description
Catalog Number:
AG01EX15
Chemical Name:
1-(4-(trifluoromethyl)-2-nitrophenyl)piperidin-4-ol
CAS Number:
702650-29-1
Molecular Formula:
C12H13F3N2O3
Molecular Weight:
290.2384
IUPAC Name:
1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-4-ol
InChI:
InChI=1S/C12H13F3N2O3/c13-12(14,15)8-1-2-10(11(7-8)17(19)20)16-5-3-9(18)4-6-16/h1-2,7,9,18H,3-6H2
InChI Key:
YCLQAAVUHAWJKH-UHFFFAOYSA-N
SMILES:
OC1CCN(CC1)c1ccc(cc1[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
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
Related Products
© 2019 Angene International Limited. All rights Reserved.