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Home > Fluorides > 1340309-40-1
1340309-40-1 | 2-(3-Fluoro-4-methoxyphenyl)-3-methyl-butan-2-ol
CAS No: 1340309-40-1 Catalog No: AG01F9HX MDL No:
Product Description
Catalog Number:
AG01F9HX
Chemical Name:
2-(3-Fluoro-4-methoxyphenyl)-3-methyl-butan-2-ol
CAS Number:
1340309-40-1
Molecular Formula:
C12H17FO2
Molecular Weight:
212.2606
IUPAC Name:
2-(3-fluoro-4-methoxyphenyl)-3-methylbutan-2-ol
InChI:
InChI=1S/C12H17FO2/c1-8(2)12(3,14)9-5-6-11(15-4)10(13)7-9/h5-8,14H,1-4H3
InChI Key:
SQXZUUOKRYYTMC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)C(C(C)C)(O)C
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.264g/mol
Monoisotopic Mass:
212.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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