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Home > Fluorides > 117113-98-1
117113-98-1 | Benzenemethanol, 4-[(4-fluorophenyl)methoxy]-
CAS No: 117113-98-1 Catalog No: AG000DRG MDL No:MFCD00173648
Product Description
Catalog Number:
AG000DRG
Chemical Name:
Benzenemethanol, 4-[(4-fluorophenyl)methoxy]-
CAS Number:
117113-98-1
Molecular Formula:
C14H13FO2
Molecular Weight:
232.2502
MDL Number:
MFCD00173648
IUPAC Name:
[4-[(4-fluorophenyl)methoxy]phenyl]methanol
InChI:
InChI=1S/C14H13FO2/c15-13-5-1-12(2-6-13)10-17-14-7-3-11(9-16)4-8-14/h1-8,16H,9-10H2
InChI Key:
FNWSEJASZBRBDB-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)OCc1ccc(cc1)F
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.09g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.254g/mol
Monoisotopic Mass:
232.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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