8-methylnonadec-1-ene

C20H40 — CID 90877384

IUPAC8-methylnonadec-1-ene
SMILESC=CCCCCCC(C)CCCCCCCCCCC
InChIInChI=1S/C20H40/c1-4-6-8-10-11-12-13-15-17-19-20(3)18-16-14-9-7-5-2/h5,20H,2,4,6-19H2,1,3H3
InChIKeyVLMZDBRSODHVCA-UHFFFAOYSA-N
MW280.54 g/mol
LogP7.68
Rot. Bonds16

About 8-methylnonadec-1-ene

8-methylnonadec-1-ene (PubChem CID 90877384) has the molecular formula C20H40 and a molecular weight of 280.54 g/mol. Its IUPAC name is 8-methylnonadec-1-ene.

Molecular Properties

Compound Name8-methylnonadec-1-ene
PubChem CID90877384
Molecular FormulaC20H40
Molecular Weight280.54 g/mol
Exact Mass280.31
IUPAC Name8-methylnonadec-1-ene
SMILESC=CCCCCCC(C)CCCCCCCCCCC
InChIInChI=1S/C20H40/c1-4-6-8-10-11-12-13-15-17-19-20(3)18-16-14-9-7-5-2/h5,20H,2,4,6-19H2,1,3H3
InChIKeyVLMZDBRSODHVCA-UHFFFAOYSA-N
XLogP7.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.54
LogP ≤ 57.68
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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Related Compounds

7-methylundec-1-ene
CID 522554
5-methylheptadec-1-ene
CID 172780073
5-methylicos-1-ene
CID 145462707
13-methylhexadec-1-ene
CID 71373615
14,18,22-trimethylpentacos-1-ene
CID 91259502
11-methyltridec-1-ene
CID 528465
7-pentyltridec-1-ene
CID 123620244
14-methylhexadec-1-ene
CID 86185732
12-pentyltricosa-1,22-diene
CID 102409743
26-heptadecylnonapentacont-1-ene
CID 123445046
non-1-ene
CID 141296734
hexane;octadec-1-ene
CID 175577514

Frequently Asked Questions

What is the IUPAC name of 8-methylnonadec-1-ene?
The IUPAC name of 8-methylnonadec-1-ene (CID 90877384) is 8-methylnonadec-1-ene.
What is the SMILES notation for 8-methylnonadec-1-ene?
The canonical SMILES for 8-methylnonadec-1-ene is C=CCCCCCC(C)CCCCCCCCCCC.
What is the InChIKey of 8-methylnonadec-1-ene?
The InChIKey is VLMZDBRSODHVCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40/c1-4-6-8-10-11-12-13-15-17-19-20(3)18-16-14-9-7-5-2/h5,20H,2,4,6-19H2,1,3H3.
What are the key properties of 8-methylnonadec-1-ene?
8-methylnonadec-1-ene has a molecular weight of 280.54 g/mol, XLogP of 7.68, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylnonadec-1-ene is sourced from PubChem (CID 90877384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).