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Home > Fluorides > 1443333-48-9
1443333-48-9 | 2-(3,4-Difluoro-5-methoxyphenyl)-3-methyl-butan-2-ol
CAS No: 1443333-48-9 Catalog No: AG01F8K5 MDL No:
Product Description
Catalog Number:
AG01F8K5
Chemical Name:
2-(3,4-Difluoro-5-methoxyphenyl)-3-methyl-butan-2-ol
CAS Number:
1443333-48-9
Molecular Formula:
C12H16F2O2
Molecular Weight:
230.2510
IUPAC Name:
2-(3,4-difluoro-5-methoxyphenyl)-3-methylbutan-2-ol
InChI:
InChI=1S/C12H16F2O2/c1-7(2)12(3,15)8-5-9(13)11(14)10(6-8)16-4/h5-7,15H,1-4H3
InChI Key:
OZUBLXWEIRDNMZ-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1F)F)C(C(C)C)(O)C
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.112g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.255g/mol
Monoisotopic Mass:
230.112g/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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