bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate

C19H32O8 — CID 57266237

IUPACbis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate
SMILESC=CC1CC1(C(=O)OCCOCCOCC)C(=O)OCCOCCOCC
InChIInChI=1S/C19H32O8/c1-4-16-15-19(16,17(20)26-13-11-24-9-7-22-5-2)18(21)27-14-12-25-10-8-23-6-3/h4,16H,1,5-15H2,2-3H3
InChIKeyJXQLIDJEVIQWFG-UHFFFAOYSA-N
MW388.46 g/mol
LogP1.37
Rot. Bonds17

About bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate

bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate (PubChem CID 57266237) has the molecular formula C19H32O8 and a molecular weight of 388.46 g/mol. Its IUPAC name is bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate.

Molecular Properties

Compound Namebis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate
PubChem CID57266237
Molecular FormulaC19H32O8
Molecular Weight388.46 g/mol
Exact Mass388.21
IUPAC Namebis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate
SMILESC=CC1CC1(C(=O)OCCOCCOCC)C(=O)OCCOCCOCC
InChIInChI=1S/C19H32O8/c1-4-16-15-19(16,17(20)26-13-11-24-9-7-22-5-2)18(21)27-14-12-25-10-8-23-6-3/h4,16H,1,5-15H2,2-3H3
InChIKeyJXQLIDJEVIQWFG-UHFFFAOYSA-N
XLogP1.37
TPSA89.52 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds17
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.46
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-O-ethyl 1-O'-(2-phosphonooxyethyl) 2-ethenylcyclopropane-1,1-dicarboxylate
CID 59027122
1-O-ethyl 1-O'-[2-(ethylcarbamoyloxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate
CID 134227319
ethane-1,2-diol;2-ethenyl-1-ethoxycarbonylcyclopropane-1-carboxylic acid;1-O-ethyl 1-O'-(2-hydroxyethyl) 2-ethenylcyclopropane-1,1-dicarboxylate
CID 159587669
dimethyl 2-ethenylcyclopropane-1,1-dicarboxylate
CID 10464992
(E)-1,4-dibromobut-2-ene;diethyl 2-ethenylcyclopropane-1,1-dicarboxylate;diethyl propanedioate;ethane
CID 161195875
1-O'-[2-[[5-[2-(2-ethenyl-1-ethoxycarbonylcyclopropanecarbonyl)oxyethoxycarbonylamino]-1,3,3-trimethylcyclohexyl]methylcarbamoyloxy]ethyl] 1-O-ethyl 2-ethenylcyclopropane-1,1-dicarboxylate
CID 134240411
benzyl-[2-(2-ethenyl-1-ethoxycarbonylcyclopropanecarbonyl)oxyethyl]-dimethylazanium chloride
CID 20504379
1,2-diethoxyethane;ethenamine
CID 160675526
ethyl (2S)-1-amino-2-ethenylcyclopropane-1-carboxylate;hydrochloride
CID 69120014
1,2-diethoxyethane;bis(prop-2-enyl hydrogen carbonate)
CID 87594792
bis[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl] carbonate
CID 123756469
2-(1-cyano-2-ethenylcyclopropanecarbonyl)oxyethyl 1-cyano-2-ethenylcyclopropane-1-carboxylate
CID 118199304

Frequently Asked Questions

What is the IUPAC name of bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate?
The IUPAC name of bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate (CID 57266237) is bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate.
What is the SMILES notation for bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate?
The canonical SMILES for bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate is C=CC1CC1(C(=O)OCCOCCOCC)C(=O)OCCOCCOCC.
What is the InChIKey of bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate?
The InChIKey is JXQLIDJEVIQWFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32O8/c1-4-16-15-19(16,17(20)26-13-11-24-9-7-22-5-2)18(21)27-14-12-25-10-8-23-6-3/h4,16H,1,5-15H2,2-3H3.
What are the key properties of bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate?
bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate has a molecular weight of 388.46 g/mol, XLogP of 1.37, 17 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-(2-ethoxyethoxy)ethyl] 2-ethenylcyclopropane-1,1-dicarboxylate is sourced from PubChem (CID 57266237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).