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263387-09-3 | Ethanol, 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methylamino]-
CAS No: 263387-09-3 Catalog No: AG002SSC MDL No:MFCD01765376
Product Description
Catalog Number:
AG002SSC
Chemical Name:
Ethanol, 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methylamino]-
CAS Number:
263387-09-3
Molecular Formula:
C9H10ClF3N2O
Molecular Weight:
254.6367
MDL Number:
MFCD01765376
IUPAC Name:
2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-methylamino]ethanol
InChI:
InChI=1S/C9H10ClF3N2O/c1-15(2-3-16)8-7(10)4-6(5-14-8)9(11,12)13/h4-5,16H,2-3H2,1H3
InChI Key:
BCJHSVQNFZKIFL-UHFFFAOYSA-N
SMILES:
OCCNCc1ncc(cc1Cl)C(F)(F)F
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.043g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.637g/mol
Monoisotopic Mass:
254.043g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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