(5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene

C9H12 — CID 163764105

IUPAC(5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene
SMILESC/C=C1/C=CC=C1CC
InChIInChI=1S/C9H12/c1-3-8-6-5-7-9(8)4-2/h3,5-7H,4H2,1-2H3/b8-3-
InChIKeyMASXVHKENQPTBF-BAQGIRSFSA-N
MW120.19 g/mol
LogP2.84
Rot. Bonds1

About (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene

(5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene (PubChem CID 163764105) has the molecular formula C9H12 and a molecular weight of 120.19 g/mol. Its IUPAC name is (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene.

Molecular Properties

Compound Name(5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene
PubChem CID163764105
Molecular FormulaC9H12
Molecular Weight120.19 g/mol
Exact Mass120.09
IUPAC Name(5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene
SMILESC/C=C1/C=CC=C1CC
InChIInChI=1S/C9H12/c1-3-8-6-5-7-9(8)4-2/h3,5-7H,4H2,1-2H3/b8-3-
InChIKeyMASXVHKENQPTBF-BAQGIRSFSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.19
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene?
The IUPAC name of (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene (CID 163764105) is (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene.
What is the SMILES notation for (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene?
The canonical SMILES for (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene is C/C=C1/C=CC=C1CC.
What is the InChIKey of (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene?
The InChIKey is MASXVHKENQPTBF-BAQGIRSFSA-N. The full InChI is InChI=1S/C9H12/c1-3-8-6-5-7-9(8)4-2/h3,5-7H,4H2,1-2H3/b8-3-.
What are the key properties of (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene?
(5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene has a molecular weight of 120.19 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene is sourced from PubChem (CID 163764105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).