2-methyl-2-[(Z)-prop-1-enoxy]propane

C7H14O — CID 5463216

IUPAC2-methyl-2-[(Z)-prop-1-enoxy]propane
SMILESC/C=C\OC(C)(C)C
InChIInChI=1S/C7H14O/c1-5-6-8-7(2,3)4/h5-6H,1-4H3/b6-5-
InChIKeyXGCRQUBGQPXCPL-WAYWQWQTSA-N
MW114.19 g/mol
LogP2.34
Rot. Bonds1

About 2-methyl-2-[(Z)-prop-1-enoxy]propane

2-methyl-2-[(Z)-prop-1-enoxy]propane (PubChem CID 5463216) has the molecular formula C7H14O and a molecular weight of 114.19 g/mol. Its IUPAC name is 2-methyl-2-[(Z)-prop-1-enoxy]propane.

Molecular Properties

Compound Name2-methyl-2-[(Z)-prop-1-enoxy]propane
PubChem CID5463216
Molecular FormulaC7H14O
Molecular Weight114.19 g/mol
Exact Mass114.10
IUPAC Name2-methyl-2-[(Z)-prop-1-enoxy]propane
SMILESC/C=C\OC(C)(C)C
InChIInChI=1S/C7H14O/c1-5-6-8-7(2,3)4/h5-6H,1-4H3/b6-5-
InChIKeyXGCRQUBGQPXCPL-WAYWQWQTSA-N
XLogP2.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(Z)-prop-1-enoxy]propane?
The IUPAC name of 2-methyl-2-[(Z)-prop-1-enoxy]propane (CID 5463216) is 2-methyl-2-[(Z)-prop-1-enoxy]propane.
What is the SMILES notation for 2-methyl-2-[(Z)-prop-1-enoxy]propane?
The canonical SMILES for 2-methyl-2-[(Z)-prop-1-enoxy]propane is C/C=C\OC(C)(C)C.
What is the InChIKey of 2-methyl-2-[(Z)-prop-1-enoxy]propane?
The InChIKey is XGCRQUBGQPXCPL-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H14O/c1-5-6-8-7(2,3)4/h5-6H,1-4H3/b6-5-.
What are the key properties of 2-methyl-2-[(Z)-prop-1-enoxy]propane?
2-methyl-2-[(Z)-prop-1-enoxy]propane has a molecular weight of 114.19 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(Z)-prop-1-enoxy]propane is sourced from PubChem (CID 5463216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).