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55831-06-6 | 2-(4-Fluoro-1-naphthyl)-2-propanol
CAS No: 55831-06-6 Catalog No: AG01EWGB MDL No:
Product Description
Catalog Number:
AG01EWGB
Chemical Name:
2-(4-Fluoro-1-naphthyl)-2-propanol
CAS Number:
55831-06-6
Molecular Formula:
C13H13FO
Molecular Weight:
204.2401
IUPAC Name:
2-(4-fluoronaphthalen-1-yl)propan-2-ol
InChI:
InChI=1S/C13H13FO/c1-13(2,15)11-7-8-12(14)10-6-4-3-5-9(10)11/h3-8,15H,1-2H3
InChI Key:
YOROIQBWLCYNKF-UHFFFAOYSA-N
SMILES:
Fc1ccc(c2c1cccc2)C(O)(C)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.244g/mol
Monoisotopic Mass:
204.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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