(3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene

C15H22 — CID 144556498

IUPAC(3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene
SMILESC=C/C=C(\C=C/C)CC(/C=C\CC)=C/C
InChIInChI=1S/C15H22/c1-5-9-12-14(8-4)13-15(10-6-2)11-7-3/h6-12H,2,5,13H2,1,3-4H3/b11-7-,12-9-,14-8+,15-10+
InChIKeyGBKMRJKWFCFMQI-OUOXDEABSA-N
MW202.34 g/mol
LogP4.98
Rot. Bonds6

About (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene

(3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene (PubChem CID 144556498) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene.

Molecular Properties

Compound Name(3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene
PubChem CID144556498
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name(3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene
SMILESC=C/C=C(\C=C/C)CC(/C=C\CC)=C/C
InChIInChI=1S/C15H22/c1-5-9-12-14(8-4)13-15(10-6-2)11-7-3/h6-12H,2,5,13H2,1,3-4H3/b11-7-,12-9-,14-8+,15-10+
InChIKeyGBKMRJKWFCFMQI-OUOXDEABSA-N
XLogP4.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

ethane;(3Z,5Z)-4-[(E)-prop-1-enyl]octa-1,3,5-triene
CID 143078245
2-[[(Z,3Z)-3-prop-2-enylidenehept-4-enyl]amino]ethanol
CID 143653650
(3Z,5Z,6Z)-4-[(Z)-prop-1-enyl]-5-propylidenenona-1,3,6-triene
CID 142312550
[(Z,2E)-2-prop-2-enylidenehex-3-enyl] N-methylcarbamate
CID 143244884
(3Z,6Z,7Z)-4-ethenyl-6-(methoxymethylidene)nona-1,3,7-triene
CID 143921031
ethane;(3Z)-4-[(Z)-prop-1-enyl]octa-1,3-diene
CID 142022123
(2E,4E)-3-ethylhepta-2,4-diene
CID 19878662
(3Z)-4-methylocta-1,3,5-triene
CID 142968936
N-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]methanimine
CID 142294235
N-[(2Z)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]methanimine
CID 166868320
(4Z)-N,2-dioxo-4-[(Z)-prop-1-enyl]hepta-4,6-dienamide;ethane
CID 143265988
(5Z)-N-ethyl-5-[(Z)-prop-1-enyl]octa-5,7-dien-3-amine
CID 142416961

Frequently Asked Questions

What is the IUPAC name of (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene?
The IUPAC name of (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene (CID 144556498) is (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene.
What is the SMILES notation for (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene?
The canonical SMILES for (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene is C=C/C=C(\C=C/C)CC(/C=C\CC)=C/C.
What is the InChIKey of (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene?
The InChIKey is GBKMRJKWFCFMQI-OUOXDEABSA-N. The full InChI is InChI=1S/C15H22/c1-5-9-12-14(8-4)13-15(10-6-2)11-7-3/h6-12H,2,5,13H2,1,3-4H3/b11-7-,12-9-,14-8+,15-10+.
What are the key properties of (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene?
(3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene has a molecular weight of 202.34 g/mol, XLogP of 4.98, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,6Z,7Z)-6-ethylidene-4-[(Z)-prop-1-enyl]deca-1,3,7-triene is sourced from PubChem (CID 144556498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).