(E)-2,2,5,5-tetramethylhex-3-ene

C10H20 — CID 5463460

IUPAC(E)-2,2,5,5-tetramethylhex-3-ene
SMILESCC(C)(C)/C=C/C(C)(C)C
InChIInChI=1S/C10H20/c1-9(2,3)7-8-10(4,5)6/h7-8H,1-6H3/b8-7+
InChIKeyUYWLQEPMPVDASH-BQYQJAHWSA-N
MW140.27 g/mol
LogP3.63
Rot. Bonds

About (E)-2,2,5,5-tetramethylhex-3-ene

(E)-2,2,5,5-tetramethylhex-3-ene (PubChem CID 5463460) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is (E)-2,2,5,5-tetramethylhex-3-ene.

Molecular Properties

Compound Name(E)-2,2,5,5-tetramethylhex-3-ene
PubChem CID5463460
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name(E)-2,2,5,5-tetramethylhex-3-ene
SMILESCC(C)(C)/C=C/C(C)(C)C
InChIInChI=1S/C10H20/c1-9(2,3)7-8-10(4,5)6/h7-8H,1-6H3/b8-7+
InChIKeyUYWLQEPMPVDASH-BQYQJAHWSA-N
XLogP3.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.63
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 (E)-2,2,5,5-tetramethylhex-3-ene?
The IUPAC name of (E)-2,2,5,5-tetramethylhex-3-ene (CID 5463460) is (E)-2,2,5,5-tetramethylhex-3-ene.
What is the SMILES notation for (E)-2,2,5,5-tetramethylhex-3-ene?
The canonical SMILES for (E)-2,2,5,5-tetramethylhex-3-ene is CC(C)(C)/C=C/C(C)(C)C.
What is the InChIKey of (E)-2,2,5,5-tetramethylhex-3-ene?
The InChIKey is UYWLQEPMPVDASH-BQYQJAHWSA-N. The full InChI is InChI=1S/C10H20/c1-9(2,3)7-8-10(4,5)6/h7-8H,1-6H3/b8-7+.
What are the key properties of (E)-2,2,5,5-tetramethylhex-3-ene?
(E)-2,2,5,5-tetramethylhex-3-ene has a molecular weight of 140.27 g/mol, XLogP of 3.63, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,2,5,5-tetramethylhex-3-ene is sourced from PubChem (CID 5463460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).