ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene

C19H34 — CID 144942492

IUPACethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene
SMILESC=C/C=C(\C/C=C/C)C(CCCCC)=C(C)C.CC
InChIInChI=1S/C17H28.C2H6/c1-6-9-11-14-17(15(4)5)16(12-8-3)13-10-7-2;1-2/h7-8,10,12H,3,6,9,11,13-14H2,1-2,4-5H3;1-2H3/b10-7+,16-12+;
InChIKeyMOIOUMBOTVAETM-KRPVEDAVSA-N
MW262.48 g/mol
LogP7.01
Rot. Bonds8

About ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene

ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene (PubChem CID 144942492) has the molecular formula C19H34 and a molecular weight of 262.48 g/mol. Its IUPAC name is ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene.

Molecular Properties

Compound Nameethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene
PubChem CID144942492
Molecular FormulaC19H34
Molecular Weight262.48 g/mol
Exact Mass262.27
IUPAC Nameethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene
SMILESC=C/C=C(\C/C=C/C)C(CCCCC)=C(C)C.CC
InChIInChI=1S/C17H28.C2H6/c1-6-9-11-14-17(15(4)5)16(12-8-3)13-10-7-2;1-2/h7-8,10,12H,3,6,9,11,13-14H2,1-2,4-5H3;1-2H3/b10-7+,16-12+;
InChIKeyMOIOUMBOTVAETM-KRPVEDAVSA-N
XLogP7.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.48
LogP ≤ 57.01
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

4-methylnona-1,3-diene
CID 71327710
5-propan-2-ylidenenon-2-ene
CID 151139066
ethane;(3Z)-4-[(Z)-prop-1-enyl]octa-1,3-diene
CID 142022123
ethane;(3Z,5Z)-5-ethyl-4-propylhepta-1,3,5-triene
CID 143333904
(Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene
CID 156886763
3-ethylideneoct-1-ene
CID 91511297
ethane;prop-1-ene;undecane
CID 171541850
(2E,4E)-5-methyldeca-2,4-diene
CID 14899750
ethane;2-methylhept-1-ene
CID 143682307
(6E,8E)-6,9-dimethyltetradeca-6,8-diene
CID 16741365
2-pentyl-3-prop-2-enylbut-2-enedioic acid
CID 173366116
ethane;(2E,3Z)-2-ethylidene-3-propylhexa-3,5-dienal
CID 143778379

Frequently Asked Questions

What is the IUPAC name of ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene?
The IUPAC name of ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene (CID 144942492) is ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene.
What is the SMILES notation for ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene?
The canonical SMILES for ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene is C=C/C=C(\C/C=C/C)C(CCCCC)=C(C)C.CC.
What is the InChIKey of ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene?
The InChIKey is MOIOUMBOTVAETM-KRPVEDAVSA-N. The full InChI is InChI=1S/C17H28.C2H6/c1-6-9-11-14-17(15(4)5)16(12-8-3)13-10-7-2;1-2/h7-8,10,12H,3,6,9,11,13-14H2,1-2,4-5H3;1-2H3/b10-7+,16-12+;.
What are the key properties of ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene?
ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene has a molecular weight of 262.48 g/mol, XLogP of 7.01, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(E,5E)-6-propan-2-ylidene-5-prop-2-enylideneundec-2-ene is sourced from PubChem (CID 144942492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).