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144101-99-5 | 1,3-Dioxane, 4-(2-ethoxyethyl)-4-methyl-
CAS No: 144101-99-5 Catalog No: AG001IXR MDL No:
Product Description
Catalog Number:
AG001IXR
Chemical Name:
1,3-Dioxane, 4-(2-ethoxyethyl)-4-methyl-
CAS Number:
144101-99-5
Molecular Formula:
C9H18O3
Molecular Weight:
174.2374
IUPAC Name:
4-(2-ethoxyethyl)-4-methyl-1,3-dioxane
InChI:
InChI=1S/C9H18O3/c1-3-10-6-4-9(2)5-7-11-8-12-9/h3-8H2,1-2H3
InChI Key:
VWSQDQDFMAMNQC-UHFFFAOYSA-N
SMILES:
CCOCCC1(C)CCOCO1
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.24g/mol
Monoisotopic Mass:
174.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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