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1261232-01-2 | 4-(2-Fluoro-benzylamino)-cyclohexanol
CAS No: 1261232-01-2 Catalog No: AG01FCZN MDL No:
Product Description
Catalog Number:
AG01FCZN
Chemical Name:
4-(2-Fluoro-benzylamino)-cyclohexanol
CAS Number:
1261232-01-2
Molecular Formula:
C13H18FNO
Molecular Weight:
223.2865
IUPAC Name:
4-[(2-fluorophenyl)methylamino]cyclohexan-1-ol
InChI:
InChI=1S/C13H18FNO/c14-13-4-2-1-3-10(13)9-15-11-5-7-12(16)8-6-11/h1-4,11-12,15-16H,5-9H2
InChI Key:
NHCOMEZLJSALQB-UHFFFAOYSA-N
SMILES:
O[C@@H]1CC[C@H](CC1)NCc1ccccc1F
Properties
Complexity:
204
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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