acetylene;oxolane

C6H10O — CID 67285190

IUPACacetylene;oxolane
SMILESC#C.C1CCOC1
InChIInChI=1S/C4H8O.C2H2/c1-2-4-5-3-1;1-2/h1-4H2;1-2H
InChIKeyDPCSUYHCPWJBEX-UHFFFAOYSA-N
MW98.14 g/mol
LogP1.05
Rot. Bonds

About acetylene;oxolane

acetylene;oxolane (PubChem CID 67285190) has the molecular formula C6H10O and a molecular weight of 98.14 g/mol. Its IUPAC name is acetylene;oxolane.

Molecular Properties

Compound Nameacetylene;oxolane
PubChem CID67285190
Molecular FormulaC6H10O
Molecular Weight98.14 g/mol
Exact Mass98.07
IUPAC Nameacetylene;oxolane
SMILESC#C.C1CCOC1
InChIInChI=1S/C4H8O.C2H2/c1-2-4-5-3-1;1-2/h1-4H2;1-2H
InChIKeyDPCSUYHCPWJBEX-UHFFFAOYSA-N
XLogP1.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.14
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

aluminum;hydride;oxolane
CID 174249769
1,6,11,16,21,26,31-heptaoxacyclopentatriacontane
CID 15446455
1,6,11,16,21,26,31,36,41,46-decaoxacyclopentacontane
CID 15446458
aluminum;lithium;hydride;oxolane
CID 68813815
aluminum;lithium;hydride;oxolane
CID 68718528
1,5,10,14-tetraoxacyclooctadecane
CID 57048709
manganese;oxolane
CID 70504486
oxane;oxepane;oxocane;oxolane
CID 159745968
cycloheptane;oxolane
CID 23033083
cyclobutane;oxolane
CID 158733546
oxacyclotetracosane
CID 57108486
oxacycloheptadecane
CID 22011753

Frequently Asked Questions

What is the IUPAC name of acetylene;oxolane?
The IUPAC name of acetylene;oxolane (CID 67285190) is acetylene;oxolane.
What is the SMILES notation for acetylene;oxolane?
The canonical SMILES for acetylene;oxolane is C#C.C1CCOC1.
What is the InChIKey of acetylene;oxolane?
The InChIKey is DPCSUYHCPWJBEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.C2H2/c1-2-4-5-3-1;1-2/h1-4H2;1-2H.
What are the key properties of acetylene;oxolane?
acetylene;oxolane has a molecular weight of 98.14 g/mol, XLogP of 1.05, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetylene;oxolane is sourced from PubChem (CID 67285190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).