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16222-41-6 | Benzene, 1-(1,1-dimethylethoxy)-4-fluoro-
CAS No: 16222-41-6 Catalog No: AG001SWO MDL No:
Product Description
Catalog Number:
AG001SWO
Chemical Name:
Benzene, 1-(1,1-dimethylethoxy)-4-fluoro-
CAS Number:
16222-41-6
Molecular Formula:
C10H13FO
Molecular Weight:
168.2080
IUPAC Name:
1-fluoro-4-[(2-methylpropan-2-yl)oxy]benzene
InChI:
InChI=1S/C10H13FO/c1-10(2,3)12-9-6-4-8(11)5-7-9/h4-7H,1-3H3
InChI Key:
JFMCEYRRODNRTF-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)F)(C)C
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.211g/mol
Monoisotopic Mass:
168.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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