11-methyltridec-1-ene

C14H28 — CID 528465

IUPAC11-methyltridec-1-ene
SMILESC=CCCCCCCCCC(C)CC
InChIInChI=1S/C14H28/c1-4-6-7-8-9-10-11-12-13-14(3)5-2/h4,14H,1,5-13H2,2-3H3
InChIKeyZNRLEMSNJFBZGM-UHFFFAOYSA-N
MW196.38 g/mol
LogP5.34
Rot. Bonds10

About 11-methyltridec-1-ene

11-methyltridec-1-ene (PubChem CID 528465) has the molecular formula C14H28 and a molecular weight of 196.38 g/mol. Its IUPAC name is 11-methyltridec-1-ene.

Molecular Properties

Compound Name11-methyltridec-1-ene
PubChem CID528465
Molecular FormulaC14H28
Molecular Weight196.38 g/mol
Exact Mass196.22
IUPAC Name11-methyltridec-1-ene
SMILESC=CCCCCCCCCC(C)CC
InChIInChI=1S/C14H28/c1-4-6-7-8-9-10-11-12-13-14(3)5-2/h4,14H,1,5-13H2,2-3H3
InChIKeyZNRLEMSNJFBZGM-UHFFFAOYSA-N
XLogP5.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500196.38
LogP ≤ 55.34
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

14-methylhexadec-1-ene
CID 86185732
8-methylnonadec-1-ene
CID 90877384
13-methylhexadec-1-ene
CID 71373615
14,18,22-trimethylpentacos-1-ene
CID 91259502
3-methyldodec-11-en-5-amine
CID 107011856
7-methylundec-1-ene
CID 522554
3-methylpentadec-14-en-5-ol
CID 10823994
(8S)-9-bromo-8-methylnon-1-ene
CID 125475999
26-methylheptacos-1-ene
CID 154926473
25-methylhexacos-1-ene
CID 141407501
8-chlorodec-1-ene
CID 64507974
5-methylheptadec-1-ene
CID 172780073

Frequently Asked Questions

What is the IUPAC name of 11-methyltridec-1-ene?
The IUPAC name of 11-methyltridec-1-ene (CID 528465) is 11-methyltridec-1-ene.
What is the SMILES notation for 11-methyltridec-1-ene?
The canonical SMILES for 11-methyltridec-1-ene is C=CCCCCCCCCC(C)CC.
What is the InChIKey of 11-methyltridec-1-ene?
The InChIKey is ZNRLEMSNJFBZGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28/c1-4-6-7-8-9-10-11-12-13-14(3)5-2/h4,14H,1,5-13H2,2-3H3.
What are the key properties of 11-methyltridec-1-ene?
11-methyltridec-1-ene has a molecular weight of 196.38 g/mol, XLogP of 5.34, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyltridec-1-ene is sourced from PubChem (CID 528465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).