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1683-49-4 | 4-Piperidinol, 4-[3-(trifluoromethyl)phenyl]-, hydrochloride (1:1)
CAS No: 1683-49-4 Catalog No: AG001Y0Z MDL No:MFCD00044735
Product Description
Catalog Number:
AG001Y0Z
Chemical Name:
4-Piperidinol, 4-[3-(trifluoromethyl)phenyl]-, hydrochloride (1:1)
CAS Number:
1683-49-4
Molecular Formula:
C12H15ClF3NO
Molecular Weight:
281.7018
MDL Number:
MFCD00044735
IUPAC Name:
4-[3-(trifluoromethyl)phenyl]piperidin-4-ol;hydrochloride
InChI:
InChI=1S/C12H14F3NO.ClH/c13-12(14,15)10-3-1-2-9(8-10)11(17)4-6-16-7-5-11;/h1-3,8,16-17H,4-7H2;1H
InChI Key:
SBKPKQORDCJPSQ-UHFFFAOYSA-N
SMILES:
OC1(CCNCC1)c1cccc(c1)C(F)(F)F.Cl
EC Number:
216-863-3
NSC Number:
83235
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
281.703g/mol
Monoisotopic Mass:
281.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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 |
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