7-ethylnona-1,7-diene

C11H20 — CID 54551079

IUPAC7-ethylnona-1,7-diene
SMILESC=CCCCCC(=CC)CC
InChIInChI=1S/C11H20/c1-4-7-8-9-10-11(5-2)6-3/h4-5H,1,6-10H2,2-3H3
InChIKeyZJYRUQGLEWCEJN-UHFFFAOYSA-N
MW152.28 g/mol
LogP4.09
Rot. Bonds6

About 7-ethylnona-1,7-diene

7-ethylnona-1,7-diene (PubChem CID 54551079) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 7-ethylnona-1,7-diene.

Molecular Properties

Compound Name7-ethylnona-1,7-diene
PubChem CID54551079
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name7-ethylnona-1,7-diene
SMILESC=CCCCCC(=CC)CC
InChIInChI=1S/C11H20/c1-4-7-8-9-10-11(5-2)6-3/h4-5H,1,6-10H2,2-3H3
InChIKeyZJYRUQGLEWCEJN-UHFFFAOYSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 54.09
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

(6E)-6-ethylidenedec-1-ene
CID 173031906
17,20-diethylhexatetraconta-17,19-diene;bis(docos-1-ene);triacont-2-ene
CID 173138394
7-methylidenedec-1-ene
CID 123417470
7-ethyl-8-methylnona-1,7-diene
CID 174916778
28-hexylpentaconta-1,28-diene
CID 90932256
13-oct-7-enyltriaconta-1,13-diene
CID 123204509
8-methylidenedodec-1-ene
CID 169088157
3,8-dimethylidenetetradecane;bis(oct-1-ene)
CID 173443691
(9Z)-9-ethyl-5-methylundeca-1,5,9-triene
CID 59685224
9-methylideneicosa-1,19-diene
CID 173334659
11-methyltrideca-1,11-diene
CID 139774754
19-tetradecylideneheptatriaconta-1,28-diene
CID 173321921

Frequently Asked Questions

What is the IUPAC name of 7-ethylnona-1,7-diene?
The IUPAC name of 7-ethylnona-1,7-diene (CID 54551079) is 7-ethylnona-1,7-diene.
What is the SMILES notation for 7-ethylnona-1,7-diene?
The canonical SMILES for 7-ethylnona-1,7-diene is C=CCCCCC(=CC)CC.
What is the InChIKey of 7-ethylnona-1,7-diene?
The InChIKey is ZJYRUQGLEWCEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-4-7-8-9-10-11(5-2)6-3/h4-5H,1,6-10H2,2-3H3.
What are the key properties of 7-ethylnona-1,7-diene?
7-ethylnona-1,7-diene has a molecular weight of 152.28 g/mol, XLogP of 4.09, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethylnona-1,7-diene is sourced from PubChem (CID 54551079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).