(Z)-but-2-ene;ethane

C6H14 — CID 90897883

IUPAC(Z)-but-2-ene;ethane
SMILESC/C=C\C.CC
InChIInChI=1S/C4H8.C2H6/c1-3-4-2;1-2/h3-4H,1-2H3;1-2H3/b4-3-;
InChIKeyPMLYLCJICUMJEY-LNKPDPKZSA-N
MW86.18 g/mol
LogP2.61
Rot. Bonds

About (Z)-but-2-ene;ethane

(Z)-but-2-ene;ethane (PubChem CID 90897883) has the molecular formula C6H14 and a molecular weight of 86.18 g/mol. Its IUPAC name is (Z)-but-2-ene;ethane.

Molecular Properties

Compound Name(Z)-but-2-ene;ethane
PubChem CID90897883
Molecular FormulaC6H14
Molecular Weight86.18 g/mol
Exact Mass86.11
IUPAC Name(Z)-but-2-ene;ethane
SMILESC/C=C\C.CC
InChIInChI=1S/C4H8.C2H6/c1-3-4-2;1-2/h3-4H,1-2H3;1-2H3/b4-3-;
InChIKeyPMLYLCJICUMJEY-LNKPDPKZSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.18
LogP ≤ 52.61
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 (Z)-but-2-ene;ethane?
The IUPAC name of (Z)-but-2-ene;ethane (CID 90897883) is (Z)-but-2-ene;ethane.
What is the SMILES notation for (Z)-but-2-ene;ethane?
The canonical SMILES for (Z)-but-2-ene;ethane is C/C=C\C.CC.
What is the InChIKey of (Z)-but-2-ene;ethane?
The InChIKey is PMLYLCJICUMJEY-LNKPDPKZSA-N. The full InChI is InChI=1S/C4H8.C2H6/c1-3-4-2;1-2/h3-4H,1-2H3;1-2H3/b4-3-;.
What are the key properties of (Z)-but-2-ene;ethane?
(Z)-but-2-ene;ethane has a molecular weight of 86.18 g/mol, XLogP of 2.61, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-but-2-ene;ethane is sourced from PubChem (CID 90897883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).