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1443304-99-1 | 2-[2-(2,6-Dichloro-phenoxy)ethyl]-1,3-dioxane
CAS No: 1443304-99-1 Catalog No: AG01FAD4 MDL No:
Product Description
Catalog Number:
AG01FAD4
Chemical Name:
2-[2-(2,6-Dichloro-phenoxy)ethyl]-1,3-dioxane
CAS Number:
1443304-99-1
Molecular Formula:
C12H14Cl2O3
Molecular Weight:
277.1438
IUPAC Name:
2-[2-(2,6-dichlorophenoxy)ethyl]-1,3-dioxane
InChI:
InChI=1S/C12H14Cl2O3/c13-9-3-1-4-10(14)12(9)17-8-5-11-15-6-2-7-16-11/h1,3-4,11H,2,5-8H2
InChI Key:
FXRNHFKJQUXHIZ-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1OCCC1OCCCO1)Cl
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.032g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.141g/mol
Monoisotopic Mass:
276.032g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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