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Home > Other Building Blocks > 83466-16-4
83466-16-4 | 1,4-Dioxane, 2,3-bis(2,2-dimethylpropoxy)-, trans-
CAS No: 83466-16-4 Catalog No: AG004ROE MDL No:
Product Description
Catalog Number:
AG004ROE
Chemical Name:
1,4-Dioxane, 2,3-bis(2,2-dimethylpropoxy)-, trans-
CAS Number:
83466-16-4
Molecular Formula:
C14H28O4
Molecular Weight:
260.3697
IUPAC Name:
(2R,3R)-2,3-bis(2,2-dimethylpropoxy)-1,4-dioxane
InChI:
InChI=1S/C14H28O4/c1-13(2,3)9-17-11-12(16-8-7-15-11)18-10-14(4,5)6/h11-12H,7-10H2,1-6H3/t11-,12-/m0/s1
InChI Key:
QWJADVCUBVWJHW-RYUDHWBXSA-N
SMILES:
CC(CO[C@@H]1OCCO[C@H]1OCC(C)(C)C)(C)C
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
260.199g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.374g/mol
Monoisotopic Mass:
260.199g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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