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5-(1-Methoxyethyl)-2-methyl-5-(propan-2-yl)-1,3-dioxane

HCID 178782893
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Basic information

CAS
19476-89-2
Standard SMILES
COC(C)C1(C(C)C)COC(C)OC1
InChIKey
IXESRTVHFFPTLQ-UHFFFAOYSA-N
Molecular formula
C11H22O3
Average molar mass
202.29 g/mol

Names & identifiers

Preferred name
5-(1-Methoxyethyl)-2-methyl-5-(propan-2-yl)-1,3-dioxane
IUPAC
5-(1-methoxyethyl)-2-methyl-5-propan-2-yl-1,3-dioxane
English name
5β-Isopropyl-5α-(1-methoxyethyl)-2β-methyl-1,3-dioxane
Molecular formula
C11H22O3
Molecular weight
202.29058

Names & synonyms

DTXSID709407275-(1-Methoxyethyl)-2-methyl-5-(propan-2-yl)-1,3-dioxane19131-73-8RefChem:1072342DTXCID2013691844624-70-8m-Dioxane, 5-isopropyl-5-(1-methoxyethyl)-2-methyl-, (E)-trans-5-Isopropyl-5-(1-methoxyethyl)-2-methyl-1,3-dioxane5-(1-methoxyethyl)-2-methyl-5-propan-2-yl-1,3-dioxane5-ISOPROPYL-5-(1-METHOXYETHYL)-2-METHYL-1,3-DIOXANE19476-89-2starbld0004576
Show more names
5β-Isopropyl-5α-(1-methoxyethyl)-2β-methyl-1,3-dioxane
1,3-Dioxane, 5-(1-methoxyethyl)-2-methyl-5-(1-methylethyl)-5alpha-Isopropyl-5beta-(1-methoxyethyl)-2beta-methyl-1,3-dioxane5beta-Isopropyl-5alpha-(1-methoxyethyl)-2beta-methyl-1,3-dioxane19476-90-5orb1985650AKOS040752979T33258

Database identifiers

CAS
19476-89-2
Nikkaji
J73.748H、J73.749F

Properties

Computed structural properties

XLogP
2
Topological polar surface area
27.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
Formal charge
0
Complexity
171

Related reactions

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Compound notes

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