cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol

C24H41ClO11 — CID 159662744

IUPACcyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
SMILESO=C(Cl)C1CC1.O=C(OCCOCCOCCOC(=O)C1CC1)C1CC1.OCCOCCOCCO
InChIInChI=1S/C14H22O6.C6H14O4.C4H5ClO/c15-13(11-1-2-11)19-9-7-17-5-6-18-8-10-20-14(16)12-3-4-12;7-1-3-9-5-6-10-4-2-8;5-4(6)3-1-2-3/h11-12H,1-10H2;7-8H,1-6H2;3H,1-2H2
InChIKeyMTADSGRCNBQCPS-UHFFFAOYSA-N
MW541.03 g/mol
LogP1.09
Rot. Bonds19

About cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol

cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol (PubChem CID 159662744) has the molecular formula C24H41ClO11 and a molecular weight of 541.03 g/mol. Its IUPAC name is cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol.

Molecular Properties

Compound Namecyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
PubChem CID159662744
Molecular FormulaC24H41ClO11
Molecular Weight541.03 g/mol
Exact Mass540.23
IUPAC Namecyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
SMILESO=C(Cl)C1CC1.O=C(OCCOCCOCCOC(=O)C1CC1)C1CC1.OCCOCCOCCO
InChIInChI=1S/C14H22O6.C6H14O4.C4H5ClO/c15-13(11-1-2-11)19-9-7-17-5-6-18-8-10-20-14(16)12-3-4-12;7-1-3-9-5-6-10-4-2-8;5-4(6)3-1-2-3/h11-12H,1-10H2;7-8H,1-6H2;3H,1-2H2
InChIKeyMTADSGRCNBQCPS-UHFFFAOYSA-N
XLogP1.09
TPSA147.05 Ų
H-Bond Donors2
H-Bond Acceptors11
Rotatable Bonds19
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500541.03
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

Analyze cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol 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

cyclopropanecarbonyl chloride;2-[2-(2-methoxyethoxy)ethoxy]ethanol;2-[2-(2-methoxyethoxy)ethoxy]ethyl cyclopropanecarboxylate
CID 158595485
4-[2-(2-hydroxyethoxy)ethoxycarbonyl]cyclohexane-1-carboxylic acid
CID 66983093
4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxycarbonyl]cyclohexane-1,2-dicarboxylic acid
CID 66984163
2-[2-(2-methoxyethoxy)ethoxy]ethyl cyclobutanecarboxylate
CID 10192770
4-[2-(2-ethoxyethoxy)ethoxycarbonyl]cyclohexane-1-carboxylic acid
CID 69099387
2-propoxyethyl 4-aminocyclohexane-1-carboxylate
CID 63684339
2-fluoroethyl cyclopropanecarboxylate
CID 130693210
2-(2-methoxyethoxy)ethyl 4-(aminomethyl)cyclohexane-1-carboxylate
CID 104563304
2-propoxyethyl cyclohexanecarboxylate
CID 66700127
bis[2-[2-(2-hydroxyethoxy)ethoxy]ethyl] oxalate
CID 174537242
2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethyl cyclohexanecarboxylate
CID 70391446
2-[2-[2-[2-[5-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethyl bicyclo[4.3.1]decane-3-carboxylate
CID 101156331

Frequently Asked Questions

What is the IUPAC name of cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol?
The IUPAC name of cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol (CID 159662744) is cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol.
What is the SMILES notation for cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol?
The canonical SMILES for cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol is O=C(Cl)C1CC1.O=C(OCCOCCOCCOC(=O)C1CC1)C1CC1.OCCOCCOCCO.
What is the InChIKey of cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol?
The InChIKey is MTADSGRCNBQCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O6.C6H14O4.C4H5ClO/c15-13(11-1-2-11)19-9-7-17-5-6-18-8-10-20-14(16)12-3-4-12;7-1-3-9-5-6-10-4-2-8;5-4(6)3-1-2-3/h11-12H,1-10H2;7-8H,1-6H2;3H,1-2H2.
What are the key properties of cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol?
cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol has a molecular weight of 541.03 g/mol, XLogP of 1.09, 19 rotatable bonds, 2 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropanecarbonyl chloride;2-[2-[2-(cyclopropanecarbonyloxy)ethoxy]ethoxy]ethyl cyclopropanecarboxylate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol is sourced from PubChem (CID 159662744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).