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1443336-74-0 | 2-[2-(3-Chloro-2-fluoro-phenoxy)ethyl]-1,3-dioxane
CAS No: 1443336-74-0 Catalog No: AG01F92Q MDL No:
Product Description
Catalog Number:
AG01F92Q
Chemical Name:
2-[2-(3-Chloro-2-fluoro-phenoxy)ethyl]-1,3-dioxane
CAS Number:
1443336-74-0
Molecular Formula:
C12H14ClFO3
Molecular Weight:
260.6892
IUPAC Name:
2-[2-(3-chloro-2-fluorophenoxy)ethyl]-1,3-dioxane
InChI:
InChI=1S/C12H14ClFO3/c13-9-3-1-4-10(12(9)14)15-8-5-11-16-6-2-7-17-11/h1,3-4,11H,2,5-8H2
InChI Key:
URJKCFUNTJGPBX-UHFFFAOYSA-N
SMILES:
Fc1c(OCCC2OCCCO2)cccc1Cl
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.062g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.689g/mol
Monoisotopic Mass:
260.062g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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