(Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene

C28H56 — CID 158321303

IUPAC(Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene
SMILESC=CC(C)(CC)CC.CC/C=C/C(C)CC(C)C.CC/C=C\C(C)CC(C)C
InChIInChI=1S/2C10H20.C8H16/c2*1-5-6-7-10(4)8-9(2)3;1-5-8(4,6-2)7-3/h2*6-7,9-10H,5,8H2,1-4H3;5H,1,6-7H2,2-4H3/b7-6+;7-6-;
InChIKeyGOWOXYJHACOYKD-RWANGNOISA-N
MW392.76 g/mol
LogP10.27
Rot. Bonds11

About (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene

(Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene (PubChem CID 158321303) has the molecular formula C28H56 and a molecular weight of 392.76 g/mol. Its IUPAC name is (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene.

Molecular Properties

Compound Name(Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene
PubChem CID158321303
Molecular FormulaC28H56
Molecular Weight392.76 g/mol
Exact Mass392.44
IUPAC Name(Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene
SMILESC=CC(C)(CC)CC.CC/C=C/C(C)CC(C)C.CC/C=C\C(C)CC(C)C
InChIInChI=1S/2C10H20.C8H16/c2*1-5-6-7-10(4)8-9(2)3;1-5-8(4,6-2)7-3/h2*6-7,9-10H,5,8H2,1-4H3;5H,1,6-7H2,2-4H3/b7-6+;7-6-;
InChIKeyGOWOXYJHACOYKD-RWANGNOISA-N
XLogP10.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.76
LogP ≤ 510.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene with MolForge

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Launch Full Analysis

Related Compounds

(Z)-5-methylhept-3-ene
CID 5364727
(E,5S)-5-methylnon-3-ene
CID 101420891
(Z)-2-methylhex-3-en-1-ol
CID 15174591
(E,5S)-5,6,6-trimethylhept-3-ene
CID 134979568
3-ethyl-3-methylnona-1,5,7-triene
CID 123256755
(E,5R)-2,5,7-trimethyloct-3-ene
CID 161076848
(E)-5-methyldodec-3-ene
CID 173194511
3,5-dimethylnon-6-en-2-ylsulfanylmethanamine
CID 123335153
5,7-dimethyloct-3-enoic acid
CID 162716826
4,4,5-trimethylnona-2,6-diene
CID 173213239
2-ethenyl-2,4-dimethylpentan-1-amine
CID 102640269
3,5,6,6-tetramethyloct-1-ene
CID 123650579

Frequently Asked Questions

What is the IUPAC name of (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene?
The IUPAC name of (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene (CID 158321303) is (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene.
What is the SMILES notation for (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene?
The canonical SMILES for (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene is C=CC(C)(CC)CC.CC/C=C/C(C)CC(C)C.CC/C=C\C(C)CC(C)C.
What is the InChIKey of (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene?
The InChIKey is GOWOXYJHACOYKD-RWANGNOISA-N. The full InChI is InChI=1S/2C10H20.C8H16/c2*1-5-6-7-10(4)8-9(2)3;1-5-8(4,6-2)7-3/h2*6-7,9-10H,5,8H2,1-4H3;5H,1,6-7H2,2-4H3/b7-6+;7-6-;.
What are the key properties of (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene?
(Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene has a molecular weight of 392.76 g/mol, XLogP of 10.27, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5,7-dimethyloct-3-ene;(E)-5,7-dimethyloct-3-ene;3-ethyl-3-methylpent-1-ene is sourced from PubChem (CID 158321303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).