1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one

C14H28O6 — CID 170040791

IUPAC1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one
SMILESCC(=O)COCCOCCOCCOCCOC(C)C
InChIInChI=1S/C14H28O6/c1-13(2)20-11-10-18-7-6-16-4-5-17-8-9-19-12-14(3)15/h13H,4-12H2,1-3H3
InChIKeyRVUCTJCOBUOTSJ-UHFFFAOYSA-N
MW292.37 g/mol
LogP1.07
Rot. Bonds15

About 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one

1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one (PubChem CID 170040791) has the molecular formula C14H28O6 and a molecular weight of 292.37 g/mol. Its IUPAC name is 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one.

Molecular Properties

Compound Name1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one
PubChem CID170040791
Molecular FormulaC14H28O6
Molecular Weight292.37 g/mol
Exact Mass292.19
IUPAC Name1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one
SMILESCC(=O)COCCOCCOCCOCCOC(C)C
InChIInChI=1S/C14H28O6/c1-13(2)20-11-10-18-7-6-16-4-5-17-8-9-19-12-14(3)15/h13H,4-12H2,1-3H3
InChIKeyRVUCTJCOBUOTSJ-UHFFFAOYSA-N
XLogP1.07
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-(2-propan-2-yloxyethoxy)ethoxy]acetyl chloride
CID 71371862
3-methyl-1-[2-(3-methyl-2-oxobutoxy)ethoxy]butan-2-one;2-(2-propan-2-yloxyethoxy)propane
CID 163475456
2-[2-[2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 87184275
1-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-2-one
CID 175805082
3,3-dimethyl-1-(2-propan-2-yloxyethoxy)butan-2-one
CID 43799168
N,N-dimethyl-2-(2-propan-2-yloxyethoxy)acetamide
CID 172604090
3-methyl-4-(2-propan-2-yloxyethoxy)but-2-enoic acid
CID 77005567
4-[2-[2-(2-oxopropoxy)ethoxy]ethoxy]butan-2-one
CID 59109167
1-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-one
CID 158591321
3-[2-(2-propan-2-yloxyethoxy)ethoxy]propanoic acid
CID 87458033
1-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]propan-2-one
CID 138727906
ethyl 2-(2-propan-2-yloxyethoxy)acetate
CID 43119673

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one?
The IUPAC name of 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one (CID 170040791) is 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one.
What is the SMILES notation for 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one?
The canonical SMILES for 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one is CC(=O)COCCOCCOCCOCCOC(C)C.
What is the InChIKey of 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one?
The InChIKey is RVUCTJCOBUOTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O6/c1-13(2)20-11-10-18-7-6-16-4-5-17-8-9-19-12-14(3)15/h13H,4-12H2,1-3H3.
What are the key properties of 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one?
1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one has a molecular weight of 292.37 g/mol, XLogP of 1.07, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one is sourced from PubChem (CID 170040791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).