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1261231-28-0 | 4-(4-Fluoro-benzylamino)-cyclohexanol
CAS No: 1261231-28-0 Catalog No: AG01FCZL MDL No:
Product Description
Catalog Number:
AG01FCZL
Chemical Name:
4-(4-Fluoro-benzylamino)-cyclohexanol
CAS Number:
1261231-28-0
Molecular Formula:
C13H18FNO
Molecular Weight:
223.2865
IUPAC Name:
4-[(4-fluorophenyl)methylamino]cyclohexan-1-ol
InChI:
InChI=1S/C13H18FNO/c14-11-3-1-10(2-4-11)9-15-12-5-7-13(16)8-6-12/h1-4,12-13,15-16H,5-9H2
InChI Key:
CEKDSILVRRSOTF-UHFFFAOYSA-N
SMILES:
O[C@@H]1CC[C@H](CC1)NCc1ccc(cc1)F
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.291g/mol
Monoisotopic Mass:
223.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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