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Home > Fluorides > 1251923-31-5
1251923-31-5 | 3-Azabicyclo[3.2.1]octan-8-ol, 8-(trifluoromethyl)-
CAS No: 1251923-31-5 Catalog No: AG000NBX MDL No:MFCD19442731
Product Description
Catalog Number:
AG000NBX
Chemical Name:
3-Azabicyclo[3.2.1]octan-8-ol, 8-(trifluoromethyl)-
CAS Number:
1251923-31-5
Molecular Formula:
C8H12F3NO
Molecular Weight:
195.1822
MDL Number:
MFCD19442731
IUPAC Name:
8-(trifluoromethyl)-3-azabicyclo[3.2.1]octan-8-ol
InChI:
InChI=1S/C8H12F3NO/c9-8(10,11)7(13)5-1-2-6(7)4-12-3-5/h5-6,12-13H,1-4H2
InChI Key:
CUUHUTLJPXVTIL-UHFFFAOYSA-N
SMILES:
OC1(C2CNCC1CC2)C(F)(F)F
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.087g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.185g/mol
Monoisotopic Mass:
195.087g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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