(Z)-2,2,3,5,5-pentamethylhex-3-ene

C11H22 — CID 22966710

IUPAC(Z)-2,2,3,5,5-pentamethylhex-3-ene
SMILESC/C(=C/C(C)(C)C)C(C)(C)C
InChIInChI=1S/C11H22/c1-9(11(5,6)7)8-10(2,3)4/h8H,1-7H3/b9-8-
InChIKeyDZMJPGMWDCKYSL-HJWRWDBZSA-N
MW154.30 g/mol
LogP4.02
Rot. Bonds

About (Z)-2,2,3,5,5-pentamethylhex-3-ene

(Z)-2,2,3,5,5-pentamethylhex-3-ene (PubChem CID 22966710) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is (Z)-2,2,3,5,5-pentamethylhex-3-ene.

Molecular Properties

Compound Name(Z)-2,2,3,5,5-pentamethylhex-3-ene
PubChem CID22966710
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name(Z)-2,2,3,5,5-pentamethylhex-3-ene
SMILESC/C(=C/C(C)(C)C)C(C)(C)C
InChIInChI=1S/C11H22/c1-9(11(5,6)7)8-10(2,3)4/h8H,1-7H3/b9-8-
InChIKeyDZMJPGMWDCKYSL-HJWRWDBZSA-N
XLogP4.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 54.02
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 (Z)-2,2,3,5,5-pentamethylhex-3-ene?
The IUPAC name of (Z)-2,2,3,5,5-pentamethylhex-3-ene (CID 22966710) is (Z)-2,2,3,5,5-pentamethylhex-3-ene.
What is the SMILES notation for (Z)-2,2,3,5,5-pentamethylhex-3-ene?
The canonical SMILES for (Z)-2,2,3,5,5-pentamethylhex-3-ene is C/C(=C/C(C)(C)C)C(C)(C)C.
What is the InChIKey of (Z)-2,2,3,5,5-pentamethylhex-3-ene?
The InChIKey is DZMJPGMWDCKYSL-HJWRWDBZSA-N. The full InChI is InChI=1S/C11H22/c1-9(11(5,6)7)8-10(2,3)4/h8H,1-7H3/b9-8-.
What are the key properties of (Z)-2,2,3,5,5-pentamethylhex-3-ene?
(Z)-2,2,3,5,5-pentamethylhex-3-ene has a molecular weight of 154.30 g/mol, XLogP of 4.02, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,2,3,5,5-pentamethylhex-3-ene is sourced from PubChem (CID 22966710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).