7-methylnon-1-ene

C10H20 — CID 527475

IUPAC7-methylnon-1-ene
SMILESC=CCCCCC(C)CC
InChIInChI=1S/C10H20/c1-4-6-7-8-9-10(3)5-2/h4,10H,1,5-9H2,2-3H3
InChIKeyZZYJKJGZMBFFBO-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds6

About 7-methylnon-1-ene

7-methylnon-1-ene (PubChem CID 527475) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 7-methylnon-1-ene.

Molecular Properties

Compound Name7-methylnon-1-ene
PubChem CID527475
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name7-methylnon-1-ene
SMILESC=CCCCCC(C)CC
InChIInChI=1S/C10H20/c1-4-6-7-8-9-10(3)5-2/h4,10H,1,5-9H2,2-3H3
InChIKeyZZYJKJGZMBFFBO-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-methylnon-1-ene?
The IUPAC name of 7-methylnon-1-ene (CID 527475) is 7-methylnon-1-ene.
What is the SMILES notation for 7-methylnon-1-ene?
The canonical SMILES for 7-methylnon-1-ene is C=CCCCCC(C)CC.
What is the InChIKey of 7-methylnon-1-ene?
The InChIKey is ZZYJKJGZMBFFBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-4-6-7-8-9-10(3)5-2/h4,10H,1,5-9H2,2-3H3.
What are the key properties of 7-methylnon-1-ene?
7-methylnon-1-ene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylnon-1-ene is sourced from PubChem (CID 527475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).