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844856-35-5 | 4-Fluoro-3'-methoxybenzhydrol
CAS No: 844856-35-5 Catalog No: AG01EXOY MDL No:MFCD06201346
Product Description
Catalog Number:
AG01EXOY
Chemical Name:
4-Fluoro-3'-methoxybenzhydrol
CAS Number:
844856-35-5
Molecular Formula:
C14H13FO2
Molecular Weight:
232.2502
MDL Number:
MFCD06201346
IUPAC Name:
(4-fluorophenyl)-(3-methoxyphenyl)methanol
InChI:
InChI=1S/C14H13FO2/c1-17-13-4-2-3-11(9-13)14(16)10-5-7-12(15)8-6-10/h2-9,14,16H,1H3
InChI Key:
PHFPJJBUBMSEKR-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C(c1ccc(cc1)F)O
Properties
Complexity:
226
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:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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