2-methyl-1-propan-2-yloxyprop-1-ene

C7H14O — CID 11978850

IUPAC2-methyl-1-propan-2-yloxyprop-1-ene
SMILESCC(C)=COC(C)C
InChIInChI=1S/C7H14O/c1-6(2)5-8-7(3)4/h5,7H,1-4H3
InChIKeyYWIWTYWEGLSZJH-UHFFFAOYSA-N
MW114.19 g/mol
LogP2.34
Rot. Bonds2

About 2-methyl-1-propan-2-yloxyprop-1-ene

2-methyl-1-propan-2-yloxyprop-1-ene (PubChem CID 11978850) has the molecular formula C7H14O and a molecular weight of 114.19 g/mol. Its IUPAC name is 2-methyl-1-propan-2-yloxyprop-1-ene.

Molecular Properties

Compound Name2-methyl-1-propan-2-yloxyprop-1-ene
PubChem CID11978850
Molecular FormulaC7H14O
Molecular Weight114.19 g/mol
Exact Mass114.10
IUPAC Name2-methyl-1-propan-2-yloxyprop-1-ene
SMILESCC(C)=COC(C)C
InChIInChI=1S/C7H14O/c1-6(2)5-8-7(3)4/h5,7H,1-4H3
InChIKeyYWIWTYWEGLSZJH-UHFFFAOYSA-N
XLogP2.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
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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Related Compounds

cis-1-Propenyl isopropyl ether
CID 5365243
2-Methyl-1-(2-methylprop-1-enoxy)prop-1-ene
CID 238798
1-Propene, 1-methoxy-2-methyl-
CID 551188
1-Propene, 1-(1-methylethoxy)-, (E)-
CID 5463215
1-Ethoxy-2-methylpropene
CID 11051587
Isobutenyl vinyl ether
CID 21625926
(E)-(1-Propenyl) (2-methyl-1-propenyl)ether
CID 5463204
Isopropyl-propenyl ether
CID 138148
2-[(E)-prop-1-enoxy]butane
CID 22498076
1-Methoxy-2-methyl-1-butene (trans)
CID 3033474
1-Methoxy-2-methyl-1-butene
CID 3033475
1-Fluoro-2-methyl-1-propan-2-yloxyprop-1-ene
CID 144143869

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-propan-2-yloxyprop-1-ene?
The IUPAC name of 2-methyl-1-propan-2-yloxyprop-1-ene (CID 11978850) is 2-methyl-1-propan-2-yloxyprop-1-ene.
What is the SMILES notation for 2-methyl-1-propan-2-yloxyprop-1-ene?
The canonical SMILES for 2-methyl-1-propan-2-yloxyprop-1-ene is CC(C)=COC(C)C.
What is the InChIKey of 2-methyl-1-propan-2-yloxyprop-1-ene?
The InChIKey is YWIWTYWEGLSZJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O/c1-6(2)5-8-7(3)4/h5,7H,1-4H3.
What are the key properties of 2-methyl-1-propan-2-yloxyprop-1-ene?
2-methyl-1-propan-2-yloxyprop-1-ene has a molecular weight of 114.19 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-propan-2-yloxyprop-1-ene is sourced from PubChem (CID 11978850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).