ethane;ethene;ethylcyclobutane

C10H22 — CID 164586585

IUPACethane;ethene;ethylcyclobutane
SMILESC=C.CC.CCC1CCC1
InChIInChI=1S/C6H12.C2H6.C2H4/c1-2-6-4-3-5-6;2*1-2/h6H,2-5H2,1H3;1-2H3;1-2H2
InChIKeyDEBLMARYAGHQNO-UHFFFAOYSA-N
MW142.29 g/mol
LogP4.02
Rot. Bonds1

About ethane;ethene;ethylcyclobutane

ethane;ethene;ethylcyclobutane (PubChem CID 164586585) has the molecular formula C10H22 and a molecular weight of 142.29 g/mol. Its IUPAC name is ethane;ethene;ethylcyclobutane.

Molecular Properties

Compound Nameethane;ethene;ethylcyclobutane
PubChem CID164586585
Molecular FormulaC10H22
Molecular Weight142.29 g/mol
Exact Mass142.17
IUPAC Nameethane;ethene;ethylcyclobutane
SMILESC=C.CC.CCC1CCC1
InChIInChI=1S/C6H12.C2H6.C2H4/c1-2-6-4-3-5-6;2*1-2/h6H,2-5H2,1H3;1-2H3;1-2H2
InChIKeyDEBLMARYAGHQNO-UHFFFAOYSA-N
XLogP4.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.29
LogP ≤ 54.02
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;bis(ethylcyclopentane)
CID 158911237
ethylcyclobutane;methanamine
CID 175532329
cyclopropane;ethylcyclobutane;propane
CID 142456817
cyclobutane;ethane;ethylcyclobutane;methane;methylcyclobutane
CID 158476891
chromium;bis(ethylcyclopentane)
CID 91996240
ethylcyclopentane;methane
CID 143390575
tris(ethylcyclopentane);gadolinium
CID 160752471
cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
CID 159227929
ethane;ethylcyclopropane
CID 91380076
but-1-ene;ethylcyclobutane;ethylcyclopropane;methane
CID 158958125
ethylcyclopentane;methanamine
CID 142068671
magnesium;carbanide;bis(ethylcyclopentane)
CID 121233150

Frequently Asked Questions

What is the IUPAC name of ethane;ethene;ethylcyclobutane?
The IUPAC name of ethane;ethene;ethylcyclobutane (CID 164586585) is ethane;ethene;ethylcyclobutane.
What is the SMILES notation for ethane;ethene;ethylcyclobutane?
The canonical SMILES for ethane;ethene;ethylcyclobutane is C=C.CC.CCC1CCC1.
What is the InChIKey of ethane;ethene;ethylcyclobutane?
The InChIKey is DEBLMARYAGHQNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.C2H6.C2H4/c1-2-6-4-3-5-6;2*1-2/h6H,2-5H2,1H3;1-2H3;1-2H2.
What are the key properties of ethane;ethene;ethylcyclobutane?
ethane;ethene;ethylcyclobutane has a molecular weight of 142.29 g/mol, XLogP of 4.02, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethene;ethylcyclobutane is sourced from PubChem (CID 164586585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).