trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane

C8H12 — CID 134886673

IUPACtrans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane
SMILESC=C[C@H]1C[C@@H]1/C=C/C
InChIInChI=1S/C8H12/c1-3-5-8-6-7(8)4-2/h3-5,7-8H,2,6H2,1H3/b5-3+/t7-,8-/m0/s1
InChIKeyPCTQXTPEUWPMPH-VKTMEOEOSA-N
MW108.18 g/mol
LogP2.38
Rot. Bonds2

About trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane

trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane (PubChem CID 134886673) has the molecular formula C8H12 and a molecular weight of 108.18 g/mol. Its IUPAC name is trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane.

Molecular Properties

Compound Nametrans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane
PubChem CID134886673
Molecular FormulaC8H12
Molecular Weight108.18 g/mol
Exact Mass108.09
IUPAC Nametrans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane
SMILESC=C[C@H]1C[C@@H]1/C=C/C
InChIInChI=1S/C8H12/c1-3-5-8-6-7(8)4-2/h3-5,7-8H,2,6H2,1H3/b5-3+/t7-,8-/m0/s1
InChIKeyPCTQXTPEUWPMPH-VKTMEOEOSA-N
XLogP2.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.18
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane?
The IUPAC name of trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane (CID 134886673) is trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane.
What is the SMILES notation for trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane?
The canonical SMILES for trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane is C=C[C@H]1C[C@@H]1/C=C/C.
What is the InChIKey of trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane?
The InChIKey is PCTQXTPEUWPMPH-VKTMEOEOSA-N. The full InChI is InChI=1S/C8H12/c1-3-5-8-6-7(8)4-2/h3-5,7-8H,2,6H2,1H3/b5-3+/t7-,8-/m0/s1.
What are the key properties of trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane?
trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane has a molecular weight of 108.18 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane is sourced from PubChem (CID 134886673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).