bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate

C19H32O6 — CID 118062251

IUPACbis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate
SMILESC=CC.C=CC.C=CC(=O)OCCOCC(C)OCCOC(=O)C=C
InChIInChI=1S/C13H20O6.2C3H6/c1-4-12(14)18-7-6-16-10-11(3)17-8-9-19-13(15)5-2;2*1-3-2/h4-5,11H,1-2,6-10H2,3H3;2*3H,1H2,2H3
InChIKeyCFYMTNURYXLXHN-UHFFFAOYSA-N
MW356.46 g/mol
LogP3.25
Rot. Bonds11

About bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate

bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate (PubChem CID 118062251) has the molecular formula C19H32O6 and a molecular weight of 356.46 g/mol. Its IUPAC name is bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate.

Molecular Properties

Compound Namebis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate
PubChem CID118062251
Molecular FormulaC19H32O6
Molecular Weight356.46 g/mol
Exact Mass356.22
IUPAC Namebis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate
SMILESC=CC.C=CC.C=CC(=O)OCCOCC(C)OCCOC(=O)C=C
InChIInChI=1S/C13H20O6.2C3H6/c1-4-12(14)18-7-6-16-10-11(3)17-8-9-19-13(15)5-2;2*1-3-2/h4-5,11H,1-2,6-10H2,3H3;2*3H,1H2,2H3
InChIKeyCFYMTNURYXLXHN-UHFFFAOYSA-N
XLogP3.25
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.46
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-(2-prop-2-enoyloxyethoxy)propoxy]propoxy]ethyl prop-2-enoate
CID 154586565
2-[2-(1-ethenoxypropan-2-yloxy)ethoxy]ethyl prop-2-enoate
CID 165147394
2-(2-hydroperoxypropoxy)ethyl prop-2-enoate
CID 118433563
2-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]ethyl prop-2-enoate
CID 135130322
2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]propoxy]ethyl 2-methylprop-2-enoate;bis(prop-1-ene)
CID 87981100
2-(2-aminopropoxy)ethyl prop-2-enoate
CID 54040503
2-(2-bromopropoxy)ethyl prop-2-enoate
CID 57007921
2-[2,2-bis(ethenoxy)ethoxy]ethyl prop-2-enoate
CID 176551024
2-(2-prop-2-enoyloxyethoxymethyl)propanedioic acid
CID 172861993
2-[2-(hydroxymethyl)-3-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate
CID 89425808
2-[1-[5-[1-(2-prop-2-enoyloxyethoxy)ethoxy]pentoxy]ethoxy]ethyl prop-2-enoate
CID 140791658
2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl prop-2-enoate;2-(2-hydroxypropoxy)propan-1-ol
CID 22918006

Frequently Asked Questions

What is the IUPAC name of bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate?
The IUPAC name of bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate (CID 118062251) is bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate.
What is the SMILES notation for bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate?
The canonical SMILES for bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate is C=CC.C=CC.C=CC(=O)OCCOCC(C)OCCOC(=O)C=C.
What is the InChIKey of bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate?
The InChIKey is CFYMTNURYXLXHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O6.2C3H6/c1-4-12(14)18-7-6-16-10-11(3)17-8-9-19-13(15)5-2;2*1-3-2/h4-5,11H,1-2,6-10H2,3H3;2*3H,1H2,2H3.
What are the key properties of bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate?
bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate has a molecular weight of 356.46 g/mol, XLogP of 3.25, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(prop-1-ene);2-[2-(2-prop-2-enoyloxyethoxy)propoxy]ethyl prop-2-enoate is sourced from PubChem (CID 118062251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).