7-methyl-3,6-dimethylideneoct-1-ene

C11H18 — CID 102247656

IUPAC7-methyl-3,6-dimethylideneoct-1-ene
SMILESC=CC(=C)CCC(=C)C(C)C
InChIInChI=1S/C11H18/c1-6-10(4)7-8-11(5)9(2)3/h6,9H,1,4-5,7-8H2,2-3H3
InChIKeyOBKYXCJIYOFJIO-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.72
Rot. Bonds5

About 7-methyl-3,6-dimethylideneoct-1-ene

7-methyl-3,6-dimethylideneoct-1-ene (PubChem CID 102247656) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 7-methyl-3,6-dimethylideneoct-1-ene.

Molecular Properties

Compound Name7-methyl-3,6-dimethylideneoct-1-ene
PubChem CID102247656
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name7-methyl-3,6-dimethylideneoct-1-ene
SMILESC=CC(=C)CCC(=C)C(C)C
InChIInChI=1S/C11H18/c1-6-10(4)7-8-11(5)9(2)3/h6,9H,1,4-5,7-8H2,2-3H3
InChIKeyOBKYXCJIYOFJIO-UHFFFAOYSA-N
XLogP3.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-5-methylidene-2-(4-methyl-3-methylidenepentyl)hept-6-en-1-amine
CID 130426171
ethane;(Z)-3-ethyl-7-methyl-6-methylideneoct-2-ene;prop-1-ene
CID 178040036
2,7-dimethyl-6-methylideneoctane-3-thione
CID 129154835
10-methyl-3-methylideneundec-1-ene
CID 144855567
4-methylidenehex-5-en-2-ol
CID 13427514
2-methyl-6-methylideneocta-1,7-dien-3-ol
CID 534462
6,6-dimethyl-3-methylidenehept-1-ene
CID 153290519
3,6-dimethyl-5-methylidenehept-1-ene
CID 91477493
2-methyl-5-methylidenehept-6-en-2-amine
CID 126489894
3-methylidenetridec-1-ene
CID 3776253
7-methyl-3-methylideneocta-1,6-diene
CID 173118544
2-methylidene-N,N-di(propan-2-yl)but-3-en-1-amine
CID 14644963

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3,6-dimethylideneoct-1-ene?
The IUPAC name of 7-methyl-3,6-dimethylideneoct-1-ene (CID 102247656) is 7-methyl-3,6-dimethylideneoct-1-ene.
What is the SMILES notation for 7-methyl-3,6-dimethylideneoct-1-ene?
The canonical SMILES for 7-methyl-3,6-dimethylideneoct-1-ene is C=CC(=C)CCC(=C)C(C)C.
What is the InChIKey of 7-methyl-3,6-dimethylideneoct-1-ene?
The InChIKey is OBKYXCJIYOFJIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-6-10(4)7-8-11(5)9(2)3/h6,9H,1,4-5,7-8H2,2-3H3.
What are the key properties of 7-methyl-3,6-dimethylideneoct-1-ene?
7-methyl-3,6-dimethylideneoct-1-ene has a molecular weight of 150.26 g/mol, XLogP of 3.72, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3,6-dimethylideneoct-1-ene is sourced from PubChem (CID 102247656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).