11-ethyl-9-methylidenehexadec-1-ene

C19H36 — CID 155570249

IUPAC11-ethyl-9-methylidenehexadec-1-ene
SMILESC=CCCCCCCC(=C)CC(CC)CCCCC
InChIInChI=1S/C19H36/c1-5-8-10-11-12-14-15-18(4)17-19(7-3)16-13-9-6-2/h5,19H,1,4,6-17H2,2-3H3
InChIKeyPTDUCDATECYZOQ-UHFFFAOYSA-N
MW264.50 g/mol
LogP7.07
Rot. Bonds14

About 11-ethyl-9-methylidenehexadec-1-ene

11-ethyl-9-methylidenehexadec-1-ene (PubChem CID 155570249) has the molecular formula C19H36 and a molecular weight of 264.50 g/mol. Its IUPAC name is 11-ethyl-9-methylidenehexadec-1-ene.

Molecular Properties

Compound Name11-ethyl-9-methylidenehexadec-1-ene
PubChem CID155570249
Molecular FormulaC19H36
Molecular Weight264.50 g/mol
Exact Mass264.28
IUPAC Name11-ethyl-9-methylidenehexadec-1-ene
SMILESC=CCCCCCCC(=C)CC(CC)CCCCC
InChIInChI=1S/C19H36/c1-5-8-10-11-12-14-15-18(4)17-19(7-3)16-13-9-6-2/h5,19H,1,4,6-17H2,2-3H3
InChIKeyPTDUCDATECYZOQ-UHFFFAOYSA-N
XLogP7.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.50
LogP ≤ 57.07
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

10-ethyldocos-1-ene
CID 91804827
8-ethylpentadec-1-ene
CID 91081893
9-ethylhexadec-1-ene
CID 163949602
6-ethyltridec-1-ene
CID 174048481
7-pentyltridec-1-ene
CID 123620244
12-pentyltricosa-1,22-diene
CID 102409743
26-heptadecylnonapentacont-1-ene
CID 123445046
9-butyltetracosane;icosane;oct-1-ene
CID 159857155
8-methylidenedodec-1-ene
CID 169088157
5-ethyl-3-methylidene-N-[(Z)-undec-4-enyl]decan-1-amine;prop-1-ene
CID 166117737
14-ethyl-11-methylideneoctacosane
CID 142291477
3,8-dimethylidenetetradecane;bis(oct-1-ene)
CID 173443691

Frequently Asked Questions

What is the IUPAC name of 11-ethyl-9-methylidenehexadec-1-ene?
The IUPAC name of 11-ethyl-9-methylidenehexadec-1-ene (CID 155570249) is 11-ethyl-9-methylidenehexadec-1-ene.
What is the SMILES notation for 11-ethyl-9-methylidenehexadec-1-ene?
The canonical SMILES for 11-ethyl-9-methylidenehexadec-1-ene is C=CCCCCCCC(=C)CC(CC)CCCCC.
What is the InChIKey of 11-ethyl-9-methylidenehexadec-1-ene?
The InChIKey is PTDUCDATECYZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36/c1-5-8-10-11-12-14-15-18(4)17-19(7-3)16-13-9-6-2/h5,19H,1,4,6-17H2,2-3H3.
What are the key properties of 11-ethyl-9-methylidenehexadec-1-ene?
11-ethyl-9-methylidenehexadec-1-ene has a molecular weight of 264.50 g/mol, XLogP of 7.07, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11-ethyl-9-methylidenehexadec-1-ene is sourced from PubChem (CID 155570249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).