2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane

C10H22O4 — CID 91580358

IUPAC2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane
SMILESCCOC(C)C(OC)OC(C)COC
InChIInChI=1S/C10H22O4/c1-6-13-9(3)10(12-5)14-8(2)7-11-4/h8-10H,6-7H2,1-5H3
InChIKeyAGOYIQJCMOUWLL-UHFFFAOYSA-N
MW206.28 g/mol
LogP1.44
Rot. Bonds8

About 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane

2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane (PubChem CID 91580358) has the molecular formula C10H22O4 and a molecular weight of 206.28 g/mol. Its IUPAC name is 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane.

Molecular Properties

Compound Name2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane
PubChem CID91580358
Molecular FormulaC10H22O4
Molecular Weight206.28 g/mol
Exact Mass206.15
IUPAC Name2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane
SMILESCCOC(C)C(OC)OC(C)COC
InChIInChI=1S/C10H22O4/c1-6-13-9(3)10(12-5)14-8(2)7-11-4/h8-10H,6-7H2,1-5H3
InChIKeyAGOYIQJCMOUWLL-UHFFFAOYSA-N
XLogP1.44
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,2-dimethoxypropane;thulium
CID 175866702
1,2-dimethoxypropane;ytterbium
CID 175853617
1,2-dimethoxypropane;holmium
CID 175853773
1,1-diethoxy-3-methoxy-2-(methoxymethyl)propane
CID 58765891
4-(1-methoxypropan-2-yloxy)pentan-2-amine
CID 64718914
3-ethoxy-2-methylbutanenitrile
CID 14922695
methane;1-methoxy-2-(2-methoxypropoxy)propane
CID 161499840
1-methoxypropan-2-yl 2-ethoxypropanoate
CID 88537715
1-methoxy-2-(2-methoxypropoxy)propane;pentane
CID 118376955
1,2-dimethoxypropane;1-(2-ethoxyethoxy)-2-methoxyethane
CID 158715782
(1R)-1-[(1R)-1-ethoxyethoxy]-2-methoxyethanethiol
CID 97303801
(2R,3R)-1,1,3-triethoxy-2-methylbutane
CID 129365387

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane?
The IUPAC name of 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane (CID 91580358) is 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane.
What is the SMILES notation for 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane?
The canonical SMILES for 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane is CCOC(C)C(OC)OC(C)COC.
What is the InChIKey of 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane?
The InChIKey is AGOYIQJCMOUWLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4/c1-6-13-9(3)10(12-5)14-8(2)7-11-4/h8-10H,6-7H2,1-5H3.
What are the key properties of 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane?
2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane has a molecular weight of 206.28 g/mol, XLogP of 1.44, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-methoxy-1-(1-methoxypropan-2-yloxy)propane is sourced from PubChem (CID 91580358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).