8-methyldec-1-ene

C11H22 — CID 521957

IUPAC8-methyldec-1-ene
SMILESC=CCCCCCC(C)CC
InChIInChI=1S/C11H22/c1-4-6-7-8-9-10-11(3)5-2/h4,11H,1,5-10H2,2-3H3
InChIKeyRFSMYVSHKACWAB-UHFFFAOYSA-N
MW154.30 g/mol
LogP4.17
Rot. Bonds7

About 8-methyldec-1-ene

8-methyldec-1-ene (PubChem CID 521957) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 8-methyldec-1-ene.

Molecular Properties

Compound Name8-methyldec-1-ene
PubChem CID521957
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name8-methyldec-1-ene
SMILESC=CCCCCCC(C)CC
InChIInChI=1S/C11H22/c1-4-6-7-8-9-10-11(3)5-2/h4,11H,1,5-10H2,2-3H3
InChIKeyRFSMYVSHKACWAB-UHFFFAOYSA-N
XLogP4.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 8-methyldec-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-methyldec-1-ene?
The IUPAC name of 8-methyldec-1-ene (CID 521957) is 8-methyldec-1-ene.
What is the SMILES notation for 8-methyldec-1-ene?
The canonical SMILES for 8-methyldec-1-ene is C=CCCCCCC(C)CC.
What is the InChIKey of 8-methyldec-1-ene?
The InChIKey is RFSMYVSHKACWAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-4-6-7-8-9-10-11(3)5-2/h4,11H,1,5-10H2,2-3H3.
What are the key properties of 8-methyldec-1-ene?
8-methyldec-1-ene has a molecular weight of 154.30 g/mol, XLogP of 4.17, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyldec-1-ene is sourced from PubChem (CID 521957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).