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Home > Fluorides > 1394042-80-8
1394042-80-8 | 1-(3,3-diethoxypropoxy)-4-fluorobenzene
CAS No: 1394042-80-8 Catalog No: AG019TRL MDL No:MFCD18989410
Product Description
Catalog Number:
AG019TRL
Chemical Name:
1-(3,3-diethoxypropoxy)-4-fluorobenzene
CAS Number:
1394042-80-8
Molecular Formula:
C13H19FO3
Molecular Weight:
242.2866
MDL Number:
MFCD18989410
IUPAC Name:
1-(3,3-diethoxypropoxy)-4-fluorobenzene
InChI:
InChI=1S/C13H19FO3/c1-3-15-13(16-4-2)9-10-17-12-7-5-11(14)6-8-12/h5-8,13H,3-4,9-10H2,1-2H3
InChI Key:
VHPPTLPPNAXOMZ-UHFFFAOYSA-N
SMILES:
CCOC(OCC)CCOc1ccc(cc1)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.132g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.29g/mol
Monoisotopic Mass:
242.132g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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