bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)

C32H68O4 — CID 173186866

IUPACbis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)
SMILESC=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=CC.C=CC.C=CC.C=CC.OCCO.OCCO
InChIInChI=1S/4C3H6.2C2H6O2.8C2H4/c4*1-3-2;2*3-1-2-4;8*1-2/h4*3H,1H2,2H3;2*3-4H,1-2H2;8*1-2H2
InChIKeyUCEHCIPNPYTSRP-UHFFFAOYSA-N
MW516.89 g/mol
LogP9.13
Rot. Bonds2

About bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)

bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene) (PubChem CID 173186866) has the molecular formula C32H68O4 and a molecular weight of 516.89 g/mol. Its IUPAC name is bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene).

Molecular Properties

Compound Namebis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)
PubChem CID173186866
Molecular FormulaC32H68O4
Molecular Weight516.89 g/mol
Exact Mass516.51
IUPAC Namebis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)
SMILESC=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=CC.C=CC.C=CC.C=CC.OCCO.OCCO
InChIInChI=1S/4C3H6.2C2H6O2.8C2H4/c4*1-3-2;2*3-1-2-4;8*1-2/h4*3H,1H2,2H3;2*3-4H,1-2H2;8*1-2H2
InChIKeyUCEHCIPNPYTSRP-UHFFFAOYSA-N
XLogP9.13
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500516.89
LogP ≤ 59.13
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethane-1,2-diol;propane-1,3-diol;bis(prop-1-ene)
CID 173377464
ethane-1,2-diol;propane-1,3-diol;prop-1-ene
CID 87614722
ethane-1,2-diol;propan-2-ol;prop-1-ene
CID 87786416
ethane-1,2-diol;ethene;2-methoxyethanol;tetrakis(prop-1-ene)
CID 173186876
bis(ethane-1,2-diol);ethoxyethane;bis(prop-1-ene)
CID 173332144
ethane-1,2-diol;ethoxyethane;prop-1-ene
CID 87195266
ethene;tetrakis(prop-1-ene)
CID 158667737
ethane-1,2-diol;ethene
CID 173008703
(ethane-1,2-diol);ethene
CID 173372663
buta-1,3-diene;bis(ethane-1,2-diol)
CID 87919637
ethane-1,2-diol;bis(2-methylprop-2-enoic acid);tetrakis(prop-1-ene)
CID 174760131
ethane-1,2-diol;prop-1-ene;bis(2-sulfanylacetic acid)
CID 174510482

Frequently Asked Questions

What is the IUPAC name of bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)?
The IUPAC name of bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene) (CID 173186866) is bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene).
What is the SMILES notation for bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)?
The canonical SMILES for bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene) is C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=CC.C=CC.C=CC.C=CC.OCCO.OCCO.
What is the InChIKey of bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)?
The InChIKey is UCEHCIPNPYTSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/4C3H6.2C2H6O2.8C2H4/c4*1-3-2;2*3-1-2-4;8*1-2/h4*3H,1H2,2H3;2*3-4H,1-2H2;8*1-2H2.
What are the key properties of bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene)?
bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene) has a molecular weight of 516.89 g/mol, XLogP of 9.13, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethane-1,2-diol);ethene;tetrakis(prop-1-ene) is sourced from PubChem (CID 173186866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).