7-prop-2-enyldodec-4-ene

C15H28 — CID 173342323

IUPAC7-prop-2-enyldodec-4-ene
SMILESC=CCC(CC=CCCC)CCCCC
InChIInChI=1S/C15H28/c1-4-7-9-11-14-15(12-6-3)13-10-8-5-2/h6,9,11,15H,3-5,7-8,10,12-14H2,1-2H3
InChIKeySAUCTIJKEAOVSI-UHFFFAOYSA-N
MW208.39 g/mol
LogP5.51
Rot. Bonds10

About 7-prop-2-enyldodec-4-ene

7-prop-2-enyldodec-4-ene (PubChem CID 173342323) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is 7-prop-2-enyldodec-4-ene.

Molecular Properties

Compound Name7-prop-2-enyldodec-4-ene
PubChem CID173342323
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Name7-prop-2-enyldodec-4-ene
SMILESC=CCC(CC=CCCC)CCCCC
InChIInChI=1S/C15H28/c1-4-7-9-11-14-15(12-6-3)13-10-8-5-2/h6,9,11,15H,3-5,7-8,10,12-14H2,1-2H3
InChIKeySAUCTIJKEAOVSI-UHFFFAOYSA-N
XLogP5.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500208.39
LogP ≤ 55.51
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

4-prop-2-enylpentadec-1-ene
CID 54427529
17-prop-2-enyltetratriacontane
CID 173452630
6-propylhexadec-8-ene
CID 174779500
(E)-12-propylhexacos-9-ene
CID 173194429
(4S)-4-ethyloct-1-ene
CID 129373406
(Z)-3-hex-5-enyldodec-5-enoic acid
CID 88654309
(Z)-5-ethylundec-7-en-1-amine
CID 167138520
7-pentyltridec-1-ene
CID 123620244
26-heptadecylnonapentacont-1-ene
CID 123445046
12-pentyltricosa-1,22-diene
CID 102409743
icosyl(23-prop-2-enyloctatriacontyl)phosphane;vanadium
CID 20744672
8-ethyldodec-5-ene
CID 173018114

Frequently Asked Questions

What is the IUPAC name of 7-prop-2-enyldodec-4-ene?
The IUPAC name of 7-prop-2-enyldodec-4-ene (CID 173342323) is 7-prop-2-enyldodec-4-ene.
What is the SMILES notation for 7-prop-2-enyldodec-4-ene?
The canonical SMILES for 7-prop-2-enyldodec-4-ene is C=CCC(CC=CCCC)CCCCC.
What is the InChIKey of 7-prop-2-enyldodec-4-ene?
The InChIKey is SAUCTIJKEAOVSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-4-7-9-11-14-15(12-6-3)13-10-8-5-2/h6,9,11,15H,3-5,7-8,10,12-14H2,1-2H3.
What are the key properties of 7-prop-2-enyldodec-4-ene?
7-prop-2-enyldodec-4-ene has a molecular weight of 208.39 g/mol, XLogP of 5.51, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-prop-2-enyldodec-4-ene is sourced from PubChem (CID 173342323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).