7-methoxy-7-methyl-3-methylideneoct-1-ene

C11H20O — CID 71356702

IUPAC7-methoxy-7-methyl-3-methylideneoct-1-ene
SMILESC=CC(=C)CCCC(C)(C)OC
InChIInChI=1S/C11H20O/c1-6-10(2)8-7-9-11(3,4)12-5/h6H,1-2,7-9H2,3-5H3
InChIKeyZOSWMSOQJPTZHW-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.32
Rot. Bonds6

About 7-methoxy-7-methyl-3-methylideneoct-1-ene

7-methoxy-7-methyl-3-methylideneoct-1-ene (PubChem CID 71356702) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 7-methoxy-7-methyl-3-methylideneoct-1-ene.

Molecular Properties

Compound Name7-methoxy-7-methyl-3-methylideneoct-1-ene
PubChem CID71356702
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name7-methoxy-7-methyl-3-methylideneoct-1-ene
SMILESC=CC(=C)CCCC(C)(C)OC
InChIInChI=1S/C11H20O/c1-6-10(2)8-7-9-11(3,4)12-5/h6H,1-2,7-9H2,3-5H3
InChIKeyZOSWMSOQJPTZHW-UHFFFAOYSA-N
XLogP3.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Myrcenol
CID 10975
Oxirane, 2,2-dimethyl-3-(3-methylene-4-penten-1-yl)-
CID 122371
1-Octene, 7-ethoxy-3,7-dimethyl-
CID 86128
1-Octene, 7-methoxy-3,7-dimethyl-
CID 103825
(3R)-2,2-dimethyl-3-(3-methylidenepent-4-enyl)oxirane
CID 92279147
2-Methyl-6-methyleneoct-7-en-2-yl formate
CID 3018190
7-Methoxy-2,7-dimethyloct-1-ene
CID 12641402
8-Methyl-8-propoxynon-1-ene
CID 17825193
6-Ethoxy-2,6-dimethylhept-1-ene
CID 54229525
2,2,3-Trimethyl-3-(3-methylidenepent-4-enyl)oxirane
CID 59928791
7-Butoxy-3,7-dimethyloct-1-ene
CID 71351148
(E)-8-methoxy-8-methylnon-2-ene
CID 88232509

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-7-methyl-3-methylideneoct-1-ene?
The IUPAC name of 7-methoxy-7-methyl-3-methylideneoct-1-ene (CID 71356702) is 7-methoxy-7-methyl-3-methylideneoct-1-ene.
What is the SMILES notation for 7-methoxy-7-methyl-3-methylideneoct-1-ene?
The canonical SMILES for 7-methoxy-7-methyl-3-methylideneoct-1-ene is C=CC(=C)CCCC(C)(C)OC.
What is the InChIKey of 7-methoxy-7-methyl-3-methylideneoct-1-ene?
The InChIKey is ZOSWMSOQJPTZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-6-10(2)8-7-9-11(3,4)12-5/h6H,1-2,7-9H2,3-5H3.
What are the key properties of 7-methoxy-7-methyl-3-methylideneoct-1-ene?
7-methoxy-7-methyl-3-methylideneoct-1-ene has a molecular weight of 168.28 g/mol, XLogP of 3.32, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-7-methyl-3-methylideneoct-1-ene is sourced from PubChem (CID 71356702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).