(Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene

C9H18O — CID 134978639

IUPAC(Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene
SMILESC/C=C\CCOC(C)(C)C
InChIInChI=1S/C9H18O/c1-5-6-7-8-10-9(2,3)4/h5-6H,7-8H2,1-4H3/b6-5-
InChIKeyNKHYZPUZFZQXSP-WAYWQWQTSA-N
MW142.24 g/mol
LogP2.77
Rot. Bonds3

About (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene

(Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene (PubChem CID 134978639) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene.

Molecular Properties

Compound Name(Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene
PubChem CID134978639
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name(Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene
SMILESC/C=C\CCOC(C)(C)C
InChIInChI=1S/C9H18O/c1-5-6-7-8-10-9(2,3)4/h5-6H,7-8H2,1-4H3/b6-5-
InChIKeyNKHYZPUZFZQXSP-WAYWQWQTSA-N
XLogP2.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene?
The IUPAC name of (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene (CID 134978639) is (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene.
What is the SMILES notation for (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene?
The canonical SMILES for (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene is C/C=C\CCOC(C)(C)C.
What is the InChIKey of (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene?
The InChIKey is NKHYZPUZFZQXSP-WAYWQWQTSA-N. The full InChI is InChI=1S/C9H18O/c1-5-6-7-8-10-9(2,3)4/h5-6H,7-8H2,1-4H3/b6-5-.
What are the key properties of (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene?
(Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene has a molecular weight of 142.24 g/mol, XLogP of 2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-[(2-methylpropan-2-yl)oxy]pent-2-ene is sourced from PubChem (CID 134978639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).