(6E)-6-ethylidenedec-1-ene

C12H22 — CID 173031906

IUPAC(6E)-6-ethylidenedec-1-ene
SMILESC=CCCC/C(=C/C)CCCC
InChIInChI=1S/C12H22/c1-4-7-9-11-12(6-3)10-8-5-2/h4,6H,1,5,7-11H2,2-3H3/b12-6+
InChIKeyAEXFUHQVPCYDHK-WUXMJOGZSA-N
MW166.31 g/mol
LogP4.48
Rot. Bonds7

About (6E)-6-ethylidenedec-1-ene

(6E)-6-ethylidenedec-1-ene (PubChem CID 173031906) has the molecular formula C12H22 and a molecular weight of 166.31 g/mol. Its IUPAC name is (6E)-6-ethylidenedec-1-ene.

Molecular Properties

Compound Name(6E)-6-ethylidenedec-1-ene
PubChem CID173031906
Molecular FormulaC12H22
Molecular Weight166.31 g/mol
Exact Mass166.17
IUPAC Name(6E)-6-ethylidenedec-1-ene
SMILESC=CCCC/C(=C/C)CCCC
InChIInChI=1S/C12H22/c1-4-7-9-11-12(6-3)10-8-5-2/h4,6H,1,5,7-11H2,2-3H3/b12-6+
InChIKeyAEXFUHQVPCYDHK-WUXMJOGZSA-N
XLogP4.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.31
LogP ≤ 54.48
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

7-ethylnona-1,7-diene
CID 54551079
(6Z)-6-(iodomethylidene)undec-1-ene
CID 42643792
8-methylidenedodec-1-ene
CID 169088157
(3E)-3-ethylideneheptan-1-ol
CID 134993443
(3E)-3-ethylideneoct-7-enoic acid
CID 22672889
28-hexylpentaconta-1,28-diene
CID 90932256
13-oct-7-enyltriaconta-1,13-diene
CID 123204509
6-ethylidenehexadecane
CID 169207706
hex-1-ene;zinc
CID 174554611
hex-1-ene;2-methylbut-1-ene
CID 172686626
ethane;hex-1-ene;2-methylprop-1-ene;propane
CID 144528656
but-1-ene;hex-1-ene;prop-1-ene
CID 86759030

Frequently Asked Questions

What is the IUPAC name of (6E)-6-ethylidenedec-1-ene?
The IUPAC name of (6E)-6-ethylidenedec-1-ene (CID 173031906) is (6E)-6-ethylidenedec-1-ene.
What is the SMILES notation for (6E)-6-ethylidenedec-1-ene?
The canonical SMILES for (6E)-6-ethylidenedec-1-ene is C=CCCC/C(=C/C)CCCC.
What is the InChIKey of (6E)-6-ethylidenedec-1-ene?
The InChIKey is AEXFUHQVPCYDHK-WUXMJOGZSA-N. The full InChI is InChI=1S/C12H22/c1-4-7-9-11-12(6-3)10-8-5-2/h4,6H,1,5,7-11H2,2-3H3/b12-6+.
What are the key properties of (6E)-6-ethylidenedec-1-ene?
(6E)-6-ethylidenedec-1-ene has a molecular weight of 166.31 g/mol, XLogP of 4.48, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-6-ethylidenedec-1-ene is sourced from PubChem (CID 173031906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).