trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane

C7H10 — CID 640654

IUPACtrans-(1S,2S)-1,2-bis(ethenyl)cyclopropane
SMILESC=C[C@@H]1C[C@H]1C=C
InChIInChI=1S/C7H10/c1-3-6-5-7(6)4-2/h3-4,6-7H,1-2,5H2/t6-,7-/m1/s1
InChIKeyUEYYOGFVPAORCH-RNFRBKRXSA-N
MW94.16 g/mol
LogP1.99
Rot. Bonds2

About trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane

trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane (PubChem CID 640654) has the molecular formula C7H10 and a molecular weight of 94.16 g/mol. Its IUPAC name is trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane.

Molecular Properties

Compound Nametrans-(1S,2S)-1,2-bis(ethenyl)cyclopropane
PubChem CID640654
Molecular FormulaC7H10
Molecular Weight94.16 g/mol
Exact Mass94.08
IUPAC Nametrans-(1S,2S)-1,2-bis(ethenyl)cyclopropane
SMILESC=C[C@@H]1C[C@H]1C=C
InChIInChI=1S/C7H10/c1-3-6-5-7(6)4-2/h3-4,6-7H,1-2,5H2/t6-,7-/m1/s1
InChIKeyUEYYOGFVPAORCH-RNFRBKRXSA-N
XLogP1.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.16
LogP ≤ 51.99
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-(1S,2S)-1,2-bis(ethenyl)cyclopropane?
The IUPAC name of trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane (CID 640654) is trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane.
What is the SMILES notation for trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane?
The canonical SMILES for trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane is C=C[C@@H]1C[C@H]1C=C.
What is the InChIKey of trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane?
The InChIKey is UEYYOGFVPAORCH-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H10/c1-3-6-5-7(6)4-2/h3-4,6-7H,1-2,5H2/t6-,7-/m1/s1.
What are the key properties of trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane?
trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane has a molecular weight of 94.16 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-1,2-bis(ethenyl)cyclopropane is sourced from PubChem (CID 640654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).