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Home > Bromides > 1443343-35-8
1443343-35-8 | 2-[2-(3-Bromo-6-methoxy-phenoxy)ethyl]-1,3-dioxane
CAS No: 1443343-35-8 Catalog No: AG01F936 MDL No:
Product Description
Catalog Number:
AG01F936
Chemical Name:
2-[2-(3-Bromo-6-methoxy-phenoxy)ethyl]-1,3-dioxane
CAS Number:
1443343-35-8
Molecular Formula:
C13H17BrO4
Molecular Weight:
317.1757
IUPAC Name:
2-[2-(5-bromo-2-methoxyphenoxy)ethyl]-1,3-dioxane
InChI:
InChI=1S/C13H17BrO4/c1-15-11-4-3-10(14)9-12(11)16-8-5-13-17-6-2-7-18-13/h3-4,9,13H,2,5-8H2,1H3
InChI Key:
CMKRRUYAGZSARE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCCC1OCCCO1)Br
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.031g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.179g/mol
Monoisotopic Mass:
316.031g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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