4,5-dimethoxy-2-methylpent-1-ene

C8H16O2 — CID 123601184

IUPAC4,5-dimethoxy-2-methylpent-1-ene
SMILESC=C(C)CC(COC)OC
InChIInChI=1S/C8H16O2/c1-7(2)5-8(10-4)6-9-3/h8H,1,5-6H2,2-4H3
InChIKeySFPVNIVTKSVCEV-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.61
Rot. Bonds5

About 4,5-dimethoxy-2-methylpent-1-ene

4,5-dimethoxy-2-methylpent-1-ene (PubChem CID 123601184) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 4,5-dimethoxy-2-methylpent-1-ene.

Molecular Properties

Compound Name4,5-dimethoxy-2-methylpent-1-ene
PubChem CID123601184
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name4,5-dimethoxy-2-methylpent-1-ene
SMILESC=C(C)CC(COC)OC
InChIInChI=1S/C8H16O2/c1-7(2)5-8(10-4)6-9-3/h8H,1,5-6H2,2-4H3
InChIKeySFPVNIVTKSVCEV-UHFFFAOYSA-N
XLogP1.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane
CID 16726469
(5Z)-8-(methoxymethyl)-2,6-dimethyl-3,4,7,8-tetrahydro-2H-oxocine
CID 134858500
2-Methyl-4-(4-methylpent-4-en-2-yloxy)pent-1-ene
CID 20033936
1-(2-Methoxyethoxy)-4-methylidenecyclohexane
CID 58902720
1,2-Dimethoxy-3-methylidenepentane
CID 87932706
1-(2-Methoxyethoxy)-3-methylidenecyclohexane
CID 90950095
2-Ethoxy-1-methoxy-4-methylidenecyclohexane
CID 90955684
1,2-Dimethoxy-4-methylidenecyclohexane
CID 91156260
1-(2-Ethoxyethoxy)-4-methylidenecyclohexane
CID 91464259
4-[2-(1-Methoxypropan-2-yloxy)ethoxy]-2-methylbut-1-ene
CID 118104079
5-Butan-2-yloxy-2-methylpent-1-ene
CID 123513431
1,2-Dimethoxy-4,5-dimethylidenecyclohexane
CID 123565678

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethoxy-2-methylpent-1-ene?
The IUPAC name of 4,5-dimethoxy-2-methylpent-1-ene (CID 123601184) is 4,5-dimethoxy-2-methylpent-1-ene.
What is the SMILES notation for 4,5-dimethoxy-2-methylpent-1-ene?
The canonical SMILES for 4,5-dimethoxy-2-methylpent-1-ene is C=C(C)CC(COC)OC.
What is the InChIKey of 4,5-dimethoxy-2-methylpent-1-ene?
The InChIKey is SFPVNIVTKSVCEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-7(2)5-8(10-4)6-9-3/h8H,1,5-6H2,2-4H3.
What are the key properties of 4,5-dimethoxy-2-methylpent-1-ene?
4,5-dimethoxy-2-methylpent-1-ene has a molecular weight of 144.21 g/mol, XLogP of 1.61, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethoxy-2-methylpent-1-ene is sourced from PubChem (CID 123601184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).