[(Z)-dec-4-enyl] propyl carbonate

C14H26O3 — CID 91694510

IUPAC[(Z)-dec-4-enyl] propyl carbonate
SMILESCCCCC/C=C\CCCOC(=O)OCCC
InChIInChI=1S/C14H26O3/c1-3-5-6-7-8-9-10-11-13-17-14(15)16-12-4-2/h8-9H,3-7,10-13H2,1-2H3/b9-8-
InChIKeyZYPXLWMSUJYHKM-HJWRWDBZSA-N
MW242.36 g/mol
LogP4.47
Rot. Bonds10

About [(Z)-dec-4-enyl] propyl carbonate

[(Z)-dec-4-enyl] propyl carbonate (PubChem CID 91694510) has the molecular formula C14H26O3 and a molecular weight of 242.36 g/mol. Its IUPAC name is [(Z)-dec-4-enyl] propyl carbonate.

Molecular Properties

Compound Name[(Z)-dec-4-enyl] propyl carbonate
PubChem CID91694510
Molecular FormulaC14H26O3
Molecular Weight242.36 g/mol
Exact Mass242.19
IUPAC Name[(Z)-dec-4-enyl] propyl carbonate
SMILESCCCCC/C=C\CCCOC(=O)OCCC
InChIInChI=1S/C14H26O3/c1-3-5-6-7-8-9-10-11-13-17-14(15)16-12-4-2/h8-9H,3-7,10-13H2,1-2H3/b9-8-
InChIKeyZYPXLWMSUJYHKM-HJWRWDBZSA-N
XLogP4.47
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 [(Z)-dec-4-enyl] propyl carbonate?
The IUPAC name of [(Z)-dec-4-enyl] propyl carbonate (CID 91694510) is [(Z)-dec-4-enyl] propyl carbonate.
What is the SMILES notation for [(Z)-dec-4-enyl] propyl carbonate?
The canonical SMILES for [(Z)-dec-4-enyl] propyl carbonate is CCCCC/C=C\CCCOC(=O)OCCC.
What is the InChIKey of [(Z)-dec-4-enyl] propyl carbonate?
The InChIKey is ZYPXLWMSUJYHKM-HJWRWDBZSA-N. The full InChI is InChI=1S/C14H26O3/c1-3-5-6-7-8-9-10-11-13-17-14(15)16-12-4-2/h8-9H,3-7,10-13H2,1-2H3/b9-8-.
What are the key properties of [(Z)-dec-4-enyl] propyl carbonate?
[(Z)-dec-4-enyl] propyl carbonate has a molecular weight of 242.36 g/mol, XLogP of 4.47, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-dec-4-enyl] propyl carbonate is sourced from PubChem (CID 91694510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).