(E,6R)-2,3,6,7-tetramethyloct-4-ene

C12H24 — CID 58933362

IUPAC(E,6R)-2,3,6,7-tetramethyloct-4-ene
SMILESCC(C)C(C)/C=C/[C@H](C)C(C)C
InChIInChI=1S/C12H24/c1-9(2)11(5)7-8-12(6)10(3)4/h7-12H,1-6H3/b8-7+/t11-,12?/m0/s1
InChIKeyTYTFORXQYQCIPE-DTNZUVIQSA-N
MW168.32 g/mol
LogP4.13
Rot. Bonds4

About (E,6R)-2,3,6,7-tetramethyloct-4-ene

(E,6R)-2,3,6,7-tetramethyloct-4-ene (PubChem CID 58933362) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is (E,6R)-2,3,6,7-tetramethyloct-4-ene.

Molecular Properties

Compound Name(E,6R)-2,3,6,7-tetramethyloct-4-ene
PubChem CID58933362
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name(E,6R)-2,3,6,7-tetramethyloct-4-ene
SMILESCC(C)C(C)/C=C/[C@H](C)C(C)C
InChIInChI=1S/C12H24/c1-9(2)11(5)7-8-12(6)10(3)4/h7-12H,1-6H3/b8-7+/t11-,12?/m0/s1
InChIKeyTYTFORXQYQCIPE-DTNZUVIQSA-N
XLogP4.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(Z,5R)-2,5,6-trimethylhept-3-ene
CID 155647530
3,4,7,8-tetramethylnona-1,5-diene
CID 123537739
(E)-2,3-dimethyloct-4-ene
CID 173368392
(Z,4R)-N,2,2,7,8-pentamethylnon-5-en-4-amine
CID 137429083
tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane
CID 102273769
(Z)-N-ethenyl-N-ethyl-3,4-dimethylpent-1-en-1-amine
CID 167218040
2,3-dimethylbutylidene(dimethyl)azanium
CID 123947542
dichloromethane;2,3-dimethylbutanal
CID 174845738
(Z)-3-ethenyl-2,2,3,6,7-pentamethyloct-4-enoic acid
CID 88544450
2,6,10,11-tetramethyldodeca-2,6,8-triene
CID 123796118
(Z,3S,6S)-2,7-dimethyloct-4-ene-3,6-diamine
CID 101163776
(E,3R,6S)-2,3,6,7-tetramethyloct-4-ene;(E,3S,6S)-2,3,6,7-tetramethyloct-4-en-2-ol;(E,3R,6S)-2,3,6,7-tetramethyloct-4-en-2-ol;(3R)-2,3,7-trimethyloctane;(6R)-2,6,7-trimethyloctan-2-ol
CID 158462965

Frequently Asked Questions

What is the IUPAC name of (E,6R)-2,3,6,7-tetramethyloct-4-ene?
The IUPAC name of (E,6R)-2,3,6,7-tetramethyloct-4-ene (CID 58933362) is (E,6R)-2,3,6,7-tetramethyloct-4-ene.
What is the SMILES notation for (E,6R)-2,3,6,7-tetramethyloct-4-ene?
The canonical SMILES for (E,6R)-2,3,6,7-tetramethyloct-4-ene is CC(C)C(C)/C=C/[C@H](C)C(C)C.
What is the InChIKey of (E,6R)-2,3,6,7-tetramethyloct-4-ene?
The InChIKey is TYTFORXQYQCIPE-DTNZUVIQSA-N. The full InChI is InChI=1S/C12H24/c1-9(2)11(5)7-8-12(6)10(3)4/h7-12H,1-6H3/b8-7+/t11-,12?/m0/s1.
What are the key properties of (E,6R)-2,3,6,7-tetramethyloct-4-ene?
(E,6R)-2,3,6,7-tetramethyloct-4-ene has a molecular weight of 168.32 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E,6R)-2,3,6,7-tetramethyloct-4-ene is sourced from PubChem (CID 58933362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).