6-methylnon-2-ene

C10H20 — CID 21361194

IUPAC6-methylnon-2-ene
SMILESCC=CCCC(C)CCC
InChIInChI=1S/C10H20/c1-4-6-7-9-10(3)8-5-2/h4,6,10H,5,7-9H2,1-3H3
InChIKeyIFTVAJWOTHCTLM-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds5

About 6-methylnon-2-ene

6-methylnon-2-ene (PubChem CID 21361194) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 6-methylnon-2-ene.

Molecular Properties

Compound Name6-methylnon-2-ene
PubChem CID21361194
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name6-methylnon-2-ene
SMILESCC=CCCC(C)CCC
InChIInChI=1S/C10H20/c1-4-6-7-9-10(3)8-5-2/h4,6,10H,5,7-9H2,1-3H3
InChIKeyIFTVAJWOTHCTLM-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-methylnon-2-ene?
The IUPAC name of 6-methylnon-2-ene (CID 21361194) is 6-methylnon-2-ene.
What is the SMILES notation for 6-methylnon-2-ene?
The canonical SMILES for 6-methylnon-2-ene is CC=CCCC(C)CCC.
What is the InChIKey of 6-methylnon-2-ene?
The InChIKey is IFTVAJWOTHCTLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-4-6-7-9-10(3)8-5-2/h4,6,10H,5,7-9H2,1-3H3.
What are the key properties of 6-methylnon-2-ene?
6-methylnon-2-ene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylnon-2-ene is sourced from PubChem (CID 21361194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).