5-ethyl-4,6-dimethylhepta-2,3-diene

C11H20 — CID 123831861

IUPAC5-ethyl-4,6-dimethylhepta-2,3-diene
SMILESCC=C=C(C)C(CC)C(C)C
InChIInChI=1S/C11H20/c1-6-8-10(5)11(7-2)9(3)4/h6,9,11H,7H2,1-5H3
InChIKeyHNVLONGQGAIFMO-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.79
Rot. Bonds3

About 5-ethyl-4,6-dimethylhepta-2,3-diene

5-ethyl-4,6-dimethylhepta-2,3-diene (PubChem CID 123831861) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 5-ethyl-4,6-dimethylhepta-2,3-diene.

Molecular Properties

Compound Name5-ethyl-4,6-dimethylhepta-2,3-diene
PubChem CID123831861
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name5-ethyl-4,6-dimethylhepta-2,3-diene
SMILESCC=C=C(C)C(CC)C(C)C
InChIInChI=1S/C11H20/c1-6-8-10(5)11(7-2)9(3)4/h6,9,11H,7H2,1-5H3
InChIKeyHNVLONGQGAIFMO-UHFFFAOYSA-N
XLogP3.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4,6-dimethylhepta-2,3-diene?
The IUPAC name of 5-ethyl-4,6-dimethylhepta-2,3-diene (CID 123831861) is 5-ethyl-4,6-dimethylhepta-2,3-diene.
What is the SMILES notation for 5-ethyl-4,6-dimethylhepta-2,3-diene?
The canonical SMILES for 5-ethyl-4,6-dimethylhepta-2,3-diene is CC=C=C(C)C(CC)C(C)C.
What is the InChIKey of 5-ethyl-4,6-dimethylhepta-2,3-diene?
The InChIKey is HNVLONGQGAIFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-6-8-10(5)11(7-2)9(3)4/h6,9,11H,7H2,1-5H3.
What are the key properties of 5-ethyl-4,6-dimethylhepta-2,3-diene?
5-ethyl-4,6-dimethylhepta-2,3-diene has a molecular weight of 152.28 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4,6-dimethylhepta-2,3-diene is sourced from PubChem (CID 123831861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).