but-1-ene;but-2-ene;prop-1-ene

C11H22 — CID 160918287

IUPACbut-1-ene;but-2-ene;prop-1-ene
SMILESC=CC.C=CCC.CC=CC
InChIInChI=1S/2C4H8.C3H6/c2*1-3-4-2;1-3-2/h3-4H,1-2H3;3H,1,4H2,2H3;3H,1H2,2H3
InChIKeySRRSNLDAFRCBIH-UHFFFAOYSA-N
MW154.30 g/mol
LogP4.36
Rot. Bonds1

About but-1-ene;but-2-ene;prop-1-ene

but-1-ene;but-2-ene;prop-1-ene (PubChem CID 160918287) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is but-1-ene;but-2-ene;prop-1-ene.

Molecular Properties

Compound Namebut-1-ene;but-2-ene;prop-1-ene
PubChem CID160918287
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Namebut-1-ene;but-2-ene;prop-1-ene
SMILESC=CC.C=CCC.CC=CC
InChIInChI=1S/2C4H8.C3H6/c2*1-3-4-2;1-3-2/h3-4H,1-2H3;3H,1,4H2,2H3;3H,1H2,2H3
InChIKeySRRSNLDAFRCBIH-UHFFFAOYSA-N
XLogP4.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 54.36
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

buta-1,3-diene;but-1-ene;prop-1-ene
CID 161064943
but-1-ene;dihydrofluoride
CID 175726295
but-1-ene;ethene
CID 19017343
but-1-ene;(Z)-pent-2-ene
CID 156866422
CID 160723056
CID 160723056
but-2-ene;bis(prop-1-ene)
CID 157334183
but-1-ene;methanethiol
CID 174505705
butane;bis(but-1-ene)
CID 160596310
(Z)-but-2-ene;ethene;bis(prop-1-ene)
CID 160593626
(Z)-but-2-ene;ethane;bis(prop-1-ene)
CID 144848347
but-1-ene;formonitrile
CID 175774246
but-1-ene;ethane;ethene;propane
CID 144521241

Frequently Asked Questions

What is the IUPAC name of but-1-ene;but-2-ene;prop-1-ene?
The IUPAC name of but-1-ene;but-2-ene;prop-1-ene (CID 160918287) is but-1-ene;but-2-ene;prop-1-ene.
What is the SMILES notation for but-1-ene;but-2-ene;prop-1-ene?
The canonical SMILES for but-1-ene;but-2-ene;prop-1-ene is C=CC.C=CCC.CC=CC.
What is the InChIKey of but-1-ene;but-2-ene;prop-1-ene?
The InChIKey is SRRSNLDAFRCBIH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H8.C3H6/c2*1-3-4-2;1-3-2/h3-4H,1-2H3;3H,1,4H2,2H3;3H,1H2,2H3.
What are the key properties of but-1-ene;but-2-ene;prop-1-ene?
but-1-ene;but-2-ene;prop-1-ene has a molecular weight of 154.30 g/mol, XLogP of 4.36, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-1-ene;but-2-ene;prop-1-ene is sourced from PubChem (CID 160918287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).