2-butoxyethyl acetate;2-propoxyethyl acetate

C15H30O6 — CID 88726109

IUPAC2-butoxyethyl acetate;2-propoxyethyl acetate
SMILESCCCCOCCOC(C)=O.CCCOCCOC(C)=O
InChIInChI=1S/C8H16O3.C7H14O3/c1-3-4-5-10-6-7-11-8(2)9;1-3-4-9-5-6-10-7(2)8/h3-7H2,1-2H3;3-6H2,1-2H3
InChIKeyZTOKIYKLXMDKTA-UHFFFAOYSA-N
MW306.40 g/mol
LogP2.34
Rot. Bonds11

About 2-butoxyethyl acetate;2-propoxyethyl acetate

2-butoxyethyl acetate;2-propoxyethyl acetate (PubChem CID 88726109) has the molecular formula C15H30O6 and a molecular weight of 306.40 g/mol. Its IUPAC name is 2-butoxyethyl acetate;2-propoxyethyl acetate.

Molecular Properties

Compound Name2-butoxyethyl acetate;2-propoxyethyl acetate
PubChem CID88726109
Molecular FormulaC15H30O6
Molecular Weight306.40 g/mol
Exact Mass306.20
IUPAC Name2-butoxyethyl acetate;2-propoxyethyl acetate
SMILESCCCCOCCOC(C)=O.CCCOCCOC(C)=O
InChIInChI=1S/C8H16O3.C7H14O3/c1-3-4-5-10-6-7-11-8(2)9;1-3-4-9-5-6-10-7(2)8/h3-7H2,1-2H3;3-6H2,1-2H3
InChIKeyZTOKIYKLXMDKTA-UHFFFAOYSA-N
XLogP2.34
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.40
LogP ≤ 52.34
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-butoxyethyl acetate;propyl acetate
CID 19764185
2-(2-butoxyethoxy)ethyl acetate;2-butoxyethyl acetate
CID 158130160
2-[2-[2-[2-[2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl acetate
CID 6428192
2-butoxyethyl acetate;silver
CID 87311971
2-(2-butoxyethoxy)ethyl acetate;methane
CID 87739734
1-(2-butoxyethoxy)butane;2-methoxyethyl acetate
CID 90456855
2-(2-decoxyethoxy)ethyl acetate
CID 526732
2-(2-ethoxyethoxy)ethyl acetate;2-(2-propoxyethoxy)ethyl acetate
CID 162060487
potassium;hydride;2-tetradecoxyethyl acetate
CID 174815000
2-(2-butoxyethoxy)ethanol;2-(2-ethoxyethoxy)ethyl acetate
CID 161493790
2-[2-(2-hydroxyethoxy)ethoxy]ethyl acetate;1-propoxypropane
CID 87238314
2-butoxyethyl acetate;4-methylpentan-2-one
CID 157145416

Frequently Asked Questions

What is the IUPAC name of 2-butoxyethyl acetate;2-propoxyethyl acetate?
The IUPAC name of 2-butoxyethyl acetate;2-propoxyethyl acetate (CID 88726109) is 2-butoxyethyl acetate;2-propoxyethyl acetate.
What is the SMILES notation for 2-butoxyethyl acetate;2-propoxyethyl acetate?
The canonical SMILES for 2-butoxyethyl acetate;2-propoxyethyl acetate is CCCCOCCOC(C)=O.CCCOCCOC(C)=O.
What is the InChIKey of 2-butoxyethyl acetate;2-propoxyethyl acetate?
The InChIKey is ZTOKIYKLXMDKTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3.C7H14O3/c1-3-4-5-10-6-7-11-8(2)9;1-3-4-9-5-6-10-7(2)8/h3-7H2,1-2H3;3-6H2,1-2H3.
What are the key properties of 2-butoxyethyl acetate;2-propoxyethyl acetate?
2-butoxyethyl acetate;2-propoxyethyl acetate has a molecular weight of 306.40 g/mol, XLogP of 2.34, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butoxyethyl acetate;2-propoxyethyl acetate is sourced from PubChem (CID 88726109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).