2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate

C16H26O6 — CID 59793344

IUPAC2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate
SMILESC=CC(=O)OCCOCCCCCCOCCOC(=O)C=C
InChIInChI=1S/C16H26O6/c1-3-15(17)21-13-11-19-9-7-5-6-8-10-20-12-14-22-16(18)4-2/h3-4H,1-2,5-14H2
InChIKeyGIMNDOUZTMKUHI-UHFFFAOYSA-N
MW314.38 g/mol
LogP2.04
Rot. Bonds15

About 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate

2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate (PubChem CID 59793344) has the molecular formula C16H26O6 and a molecular weight of 314.38 g/mol. Its IUPAC name is 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate.

Molecular Properties

Compound Name2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate
PubChem CID59793344
Molecular FormulaC16H26O6
Molecular Weight314.38 g/mol
Exact Mass314.17
IUPAC Name2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate
SMILESC=CC(=O)OCCOCCCCCCOCCOC(=O)C=C
InChIInChI=1S/C16H26O6/c1-3-15(17)21-13-11-19-9-7-5-6-8-10-20-12-14-22-16(18)4-2/h3-4H,1-2,5-14H2
InChIKeyGIMNDOUZTMKUHI-UHFFFAOYSA-N
XLogP2.04
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate?
The IUPAC name of 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate (CID 59793344) is 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate.
What is the SMILES notation for 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate?
The canonical SMILES for 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate is C=CC(=O)OCCOCCCCCCOCCOC(=O)C=C.
What is the InChIKey of 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate?
The InChIKey is GIMNDOUZTMKUHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O6/c1-3-15(17)21-13-11-19-9-7-5-6-8-10-20-12-14-22-16(18)4-2/h3-4H,1-2,5-14H2.
What are the key properties of 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate?
2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate has a molecular weight of 314.38 g/mol, XLogP of 2.04, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate is sourced from PubChem (CID 59793344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).