cyclohexen-1-yl cyclopropanecarboxylate

C10H14O2 — CID 12049886

IUPACcyclohexen-1-yl cyclopropanecarboxylate
SMILESO=C(OC1=CCCCC1)C1CC1
InChIInChI=1S/C10H14O2/c11-10(8-6-7-8)12-9-4-2-1-3-5-9/h4,8H,1-3,5-7H2
InChIKeyCWVLZBMJRVSYDH-UHFFFAOYSA-N
MW166.22 g/mol
LogP2.40
Rot. Bonds2

About cyclohexen-1-yl cyclopropanecarboxylate

cyclohexen-1-yl cyclopropanecarboxylate (PubChem CID 12049886) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is cyclohexen-1-yl cyclopropanecarboxylate.

Molecular Properties

Compound Namecyclohexen-1-yl cyclopropanecarboxylate
PubChem CID12049886
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Namecyclohexen-1-yl cyclopropanecarboxylate
SMILESO=C(OC1=CCCCC1)C1CC1
InChIInChI=1S/C10H14O2/c11-10(8-6-7-8)12-9-4-2-1-3-5-9/h4,8H,1-3,5-7H2
InChIKeyCWVLZBMJRVSYDH-UHFFFAOYSA-N
XLogP2.40
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-yl cyclopropanecarboxylate?
The IUPAC name of cyclohexen-1-yl cyclopropanecarboxylate (CID 12049886) is cyclohexen-1-yl cyclopropanecarboxylate.
What is the SMILES notation for cyclohexen-1-yl cyclopropanecarboxylate?
The canonical SMILES for cyclohexen-1-yl cyclopropanecarboxylate is O=C(OC1=CCCCC1)C1CC1.
What is the InChIKey of cyclohexen-1-yl cyclopropanecarboxylate?
The InChIKey is CWVLZBMJRVSYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c11-10(8-6-7-8)12-9-4-2-1-3-5-9/h4,8H,1-3,5-7H2.
What are the key properties of cyclohexen-1-yl cyclopropanecarboxylate?
cyclohexen-1-yl cyclopropanecarboxylate has a molecular weight of 166.22 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl cyclopropanecarboxylate is sourced from PubChem (CID 12049886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).