ethane;ethene

C22H62 — CID 143720951

IUPACethane;ethene
SMILESC=C.C=C.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/9C2H6.2C2H4/c11*1-2/h9*1-2H3;2*1-2H2
InChIKeyXHXOPFNLIXZSQH-UHFFFAOYSA-N
MW326.74 g/mol
LogP10.84
Rot. Bonds

About ethane;ethene

ethane;ethene (PubChem CID 143720951) has the molecular formula C22H62 and a molecular weight of 326.74 g/mol. Its IUPAC name is ethane;ethene.

Molecular Properties

Compound Nameethane;ethene
PubChem CID143720951
Molecular FormulaC22H62
Molecular Weight326.74 g/mol
Exact Mass326.49
IUPAC Nameethane;ethene
SMILESC=C.C=C.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/9C2H6.2C2H4/c11*1-2/h9*1-2H3;2*1-2H2
InChIKeyXHXOPFNLIXZSQH-UHFFFAOYSA-N
XLogP10.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.74
LogP ≤ 510.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethane;ethene
CID 143337551
ethane;ethene;methoxymethane
CID 143713426
ethane;ethene;N-methylmethanamine
CID 162518422
2,2-dimethylpropane;ethane;ethene
CID 143720811
ethane;ethene;propane
CID 143348401
ethane;phosphanylphosphane
CID 90994433
ethane
CID 158108820
argon;azane;ethane;ethene;hydride;methane
CID 159403442
ethane
CID 54172484
ethene;methanol
CID 159120988
ethane;ethene;methanethiol;propane
CID 157063512
N,N-diethylethanamine;ethene
CID 90857968

Frequently Asked Questions

What is the IUPAC name of ethane;ethene?
The IUPAC name of ethane;ethene (CID 143720951) is ethane;ethene.
What is the SMILES notation for ethane;ethene?
The canonical SMILES for ethane;ethene is C=C.C=C.CC.CC.CC.CC.CC.CC.CC.CC.CC.
What is the InChIKey of ethane;ethene?
The InChIKey is XHXOPFNLIXZSQH-UHFFFAOYSA-N. The full InChI is InChI=1S/9C2H6.2C2H4/c11*1-2/h9*1-2H3;2*1-2H2.
What are the key properties of ethane;ethene?
ethane;ethene has a molecular weight of 326.74 g/mol, XLogP of 10.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethene is sourced from PubChem (CID 143720951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).