7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene

C12H16 — CID 144962487

IUPAC7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene
SMILESC=CC1=C(/C=C\C)CCC12CC2
InChIInChI=1S/C12H16/c1-3-5-10-6-7-12(8-9-12)11(10)4-2/h3-5H,2,6-9H2,1H3/b5-3-
InChIKeyBEMZOIHZMBNOJF-HYXAFXHYSA-N
MW160.26 g/mol
LogP3.62
Rot. Bonds2

About 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene

7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene (PubChem CID 144962487) has the molecular formula C12H16 and a molecular weight of 160.26 g/mol. Its IUPAC name is 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene.

Molecular Properties

Compound Name7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene
PubChem CID144962487
Molecular FormulaC12H16
Molecular Weight160.26 g/mol
Exact Mass160.13
IUPAC Name7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene
SMILESC=CC1=C(/C=C\C)CCC12CC2
InChIInChI=1S/C12H16/c1-3-5-10-6-7-12(8-9-12)11(10)4-2/h3-5H,2,6-9H2,1H3/b5-3-
InChIKeyBEMZOIHZMBNOJF-HYXAFXHYSA-N
XLogP3.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene?
The IUPAC name of 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene (CID 144962487) is 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene.
What is the SMILES notation for 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene?
The canonical SMILES for 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene is C=CC1=C(/C=C\C)CCC12CC2.
What is the InChIKey of 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene?
The InChIKey is BEMZOIHZMBNOJF-HYXAFXHYSA-N. The full InChI is InChI=1S/C12H16/c1-3-5-10-6-7-12(8-9-12)11(10)4-2/h3-5H,2,6-9H2,1H3/b5-3-.
What are the key properties of 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene?
7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene has a molecular weight of 160.26 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethenyl-6-[(Z)-prop-1-enyl]spiro[2.4]hept-6-ene is sourced from PubChem (CID 144962487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).