3,7-dimethylnona-1,2-diene

C11H20 — CID 123384763

IUPAC3,7-dimethylnona-1,2-diene
SMILESC=C=C(C)CCCC(C)CC
InChIInChI=1S/C11H20/c1-5-10(3)8-7-9-11(4)6-2/h11H,1,6-9H2,2-4H3
InChIKeyNIZUHLXVGDPFLM-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.93
Rot. Bonds5

About 3,7-dimethylnona-1,2-diene

3,7-dimethylnona-1,2-diene (PubChem CID 123384763) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 3,7-dimethylnona-1,2-diene.

Molecular Properties

Compound Name3,7-dimethylnona-1,2-diene
PubChem CID123384763
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name3,7-dimethylnona-1,2-diene
SMILESC=C=C(C)CCCC(C)CC
InChIInChI=1S/C11H20/c1-5-10(3)8-7-9-11(4)6-2/h11H,1,6-9H2,2-4H3
InChIKeyNIZUHLXVGDPFLM-UHFFFAOYSA-N
XLogP3.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3,7-dimethylnona-1,2-diene?
The IUPAC name of 3,7-dimethylnona-1,2-diene (CID 123384763) is 3,7-dimethylnona-1,2-diene.
What is the SMILES notation for 3,7-dimethylnona-1,2-diene?
The canonical SMILES for 3,7-dimethylnona-1,2-diene is C=C=C(C)CCCC(C)CC.
What is the InChIKey of 3,7-dimethylnona-1,2-diene?
The InChIKey is NIZUHLXVGDPFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-5-10(3)8-7-9-11(4)6-2/h11H,1,6-9H2,2-4H3.
What are the key properties of 3,7-dimethylnona-1,2-diene?
3,7-dimethylnona-1,2-diene has a molecular weight of 152.28 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethylnona-1,2-diene is sourced from PubChem (CID 123384763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).