1-[(E)-but-1-enyl]cyclohexene

C10H16 — CID 21464617

IUPAC1-[(E)-but-1-enyl]cyclohexene
SMILESCC/C=C/C1=CCCCC1
InChIInChI=1S/C10H16/c1-2-3-7-10-8-5-4-6-9-10/h3,7-8H,2,4-6,9H2,1H3/b7-3+
InChIKeyFRZBIHBPJUIPKU-XVNBXDOJSA-N
MW136.24 g/mol
LogP3.45
Rot. Bonds2

About 1-[(E)-but-1-enyl]cyclohexene

1-[(E)-but-1-enyl]cyclohexene (PubChem CID 21464617) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 1-[(E)-but-1-enyl]cyclohexene.

Molecular Properties

Compound Name1-[(E)-but-1-enyl]cyclohexene
PubChem CID21464617
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name1-[(E)-but-1-enyl]cyclohexene
SMILESCC/C=C/C1=CCCCC1
InChIInChI=1S/C10H16/c1-2-3-7-10-8-5-4-6-9-10/h3,7-8H,2,4-6,9H2,1H3/b7-3+
InChIKeyFRZBIHBPJUIPKU-XVNBXDOJSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-[(E)-but-1-enyl]cyclohexene?
The IUPAC name of 1-[(E)-but-1-enyl]cyclohexene (CID 21464617) is 1-[(E)-but-1-enyl]cyclohexene.
What is the SMILES notation for 1-[(E)-but-1-enyl]cyclohexene?
The canonical SMILES for 1-[(E)-but-1-enyl]cyclohexene is CC/C=C/C1=CCCCC1.
What is the InChIKey of 1-[(E)-but-1-enyl]cyclohexene?
The InChIKey is FRZBIHBPJUIPKU-XVNBXDOJSA-N. The full InChI is InChI=1S/C10H16/c1-2-3-7-10-8-5-4-6-9-10/h3,7-8H,2,4-6,9H2,1H3/b7-3+.
What are the key properties of 1-[(E)-but-1-enyl]cyclohexene?
1-[(E)-but-1-enyl]cyclohexene has a molecular weight of 136.24 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-but-1-enyl]cyclohexene is sourced from PubChem (CID 21464617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).