ethene;bis(2,2,5,5-tetramethylhex-3-ene)

C22H44 — CID 162279391

IUPACethene;bis(2,2,5,5-tetramethylhex-3-ene)
SMILESC=C.CC(C)(C)C=CC(C)(C)C.CC(C)(C)C=CC(C)(C)C
InChIInChI=1S/2C10H20.C2H4/c2*1-9(2,3)7-8-10(4,5)6;1-2/h2*7-8H,1-6H3;1-2H2
InChIKeyPZPBPRTVDGRZSG-UHFFFAOYSA-N
MW308.59 g/mol
LogP8.07
Rot. Bonds

About ethene;bis(2,2,5,5-tetramethylhex-3-ene)

ethene;bis(2,2,5,5-tetramethylhex-3-ene) (PubChem CID 162279391) has the molecular formula C22H44 and a molecular weight of 308.59 g/mol. Its IUPAC name is ethene;bis(2,2,5,5-tetramethylhex-3-ene).

Molecular Properties

Compound Nameethene;bis(2,2,5,5-tetramethylhex-3-ene)
PubChem CID162279391
Molecular FormulaC22H44
Molecular Weight308.59 g/mol
Exact Mass308.34
IUPAC Nameethene;bis(2,2,5,5-tetramethylhex-3-ene)
SMILESC=C.CC(C)(C)C=CC(C)(C)C.CC(C)(C)C=CC(C)(C)C
InChIInChI=1S/2C10H20.C2H4/c2*1-9(2,3)7-8-10(4,5)6;1-2/h2*7-8H,1-6H3;1-2H2
InChIKeyPZPBPRTVDGRZSG-UHFFFAOYSA-N
XLogP8.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.59
LogP ≤ 58.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethene;bis(2,2,5,5-tetramethylhex-3-ene)?
The IUPAC name of ethene;bis(2,2,5,5-tetramethylhex-3-ene) (CID 162279391) is ethene;bis(2,2,5,5-tetramethylhex-3-ene).
What is the SMILES notation for ethene;bis(2,2,5,5-tetramethylhex-3-ene)?
The canonical SMILES for ethene;bis(2,2,5,5-tetramethylhex-3-ene) is C=C.CC(C)(C)C=CC(C)(C)C.CC(C)(C)C=CC(C)(C)C.
What is the InChIKey of ethene;bis(2,2,5,5-tetramethylhex-3-ene)?
The InChIKey is PZPBPRTVDGRZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H20.C2H4/c2*1-9(2,3)7-8-10(4,5)6;1-2/h2*7-8H,1-6H3;1-2H2.
What are the key properties of ethene;bis(2,2,5,5-tetramethylhex-3-ene)?
ethene;bis(2,2,5,5-tetramethylhex-3-ene) has a molecular weight of 308.59 g/mol, XLogP of 8.07, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;bis(2,2,5,5-tetramethylhex-3-ene) is sourced from PubChem (CID 162279391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).