1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane

C15H32O6 — CID 161069991

IUPAC1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane
SMILESC.CCOC(C)COC(C)=O.CCOCC(C)OC(C)=O
InChIInChI=1S/2C7H14O3.CH4/c1-4-9-6(2)5-10-7(3)8;1-4-9-5-6(2)10-7(3)8;/h2*6H,4-5H2,1-3H3;1H4
InChIKeyUENLXXGIURXZAC-UHFFFAOYSA-N
MW308.41 g/mol
LogP2.59
Rot. Bonds8

About 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane

1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane (PubChem CID 161069991) has the molecular formula C15H32O6 and a molecular weight of 308.41 g/mol. Its IUPAC name is 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane.

Molecular Properties

Compound Name1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane
PubChem CID161069991
Molecular FormulaC15H32O6
Molecular Weight308.41 g/mol
Exact Mass308.22
IUPAC Name1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane
SMILESC.CCOC(C)COC(C)=O.CCOCC(C)OC(C)=O
InChIInChI=1S/2C7H14O3.CH4/c1-4-9-6(2)5-10-7(3)8;1-4-9-5-6(2)10-7(3)8;/h2*6H,4-5H2,1-3H3;1H4
InChIKeyUENLXXGIURXZAC-UHFFFAOYSA-N
XLogP2.59
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-acetyloxypropyl acetate;ethane-1,2-diol;ethoxyethane;methoxymethane
CID 173118871
2-acetyloxypropyl acetate;propan-2-one
CID 159489239
1-ethoxypropan-2-yl acetate;1-methoxy-2-(2-methoxyethoxy)ethane
CID 158068416
(2R)-1,2-diethoxypropane
CID 92973991
1-[1-[1-(2-methylpropoxy)propan-2-yloxy]propan-2-yloxy]propan-2-yl acetate
CID 87296802
2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol
CID 158412024
acetic acid;ethoxyethane;1-methoxypropan-2-yl acetate
CID 158088534
1-methoxypropan-2-yl acetate;2-methoxypropyl acetate
CID 87233398
[(2R,3R,4R,5R)-2,3,4,5-tetraacetyloxy-6-ethoxyhexyl] acetate
CID 22212780
methoxyethane;1-methoxypropan-2-yl acetate
CID 174926561
[(2S)-1-ethoxypropan-2-yl] carbonochloridate
CID 124681021
1-(iodomethoxy)propan-2-yl acetate
CID 138608644

Frequently Asked Questions

What is the IUPAC name of 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane?
The IUPAC name of 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane (CID 161069991) is 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane.
What is the SMILES notation for 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane?
The canonical SMILES for 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane is C.CCOC(C)COC(C)=O.CCOCC(C)OC(C)=O.
What is the InChIKey of 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane?
The InChIKey is UENLXXGIURXZAC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H14O3.CH4/c1-4-9-6(2)5-10-7(3)8;1-4-9-5-6(2)10-7(3)8;/h2*6H,4-5H2,1-3H3;1H4.
What are the key properties of 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane?
1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane has a molecular weight of 308.41 g/mol, XLogP of 2.59, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxypropan-2-yl acetate;2-ethoxypropyl acetate;methane is sourced from PubChem (CID 161069991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).