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840522-20-5 | 3-(3-Fluorophenyl);phenethyl alcohol
CAS No: 840522-20-5 Catalog No: AG004Q3G MDL No:MFCD06201116
Product Description
Catalog Number:
AG004Q3G
Chemical Name:
3-(3-Fluorophenyl);phenethyl alcohol
CAS Number:
840522-20-5
Molecular Formula:
C14H13FO
Molecular Weight:
216.2508
MDL Number:
MFCD06201116
IUPAC Name:
2-[3-(3-fluorophenyl)phenyl]ethanol
InChI:
InChI=1S/C14H13FO/c15-14-6-2-5-13(10-14)12-4-1-3-11(9-12)7-8-16/h1-6,9-10,16H,7-8H2
InChI Key:
FMHKJMVEPWSTOD-UHFFFAOYSA-N
SMILES:
OCCc1cccc(c1)c1cccc(c1)F
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.255g/mol
Monoisotopic Mass:
216.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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