cyclopropanone;ethane

C7H16O — CID 90860291

IUPACcyclopropanone;ethane
SMILESCC.CC.O=C1CC1
InChIInChI=1S/C3H4O.2C2H6/c4-3-1-2-3;2*1-2/h1-2H2;2*1-2H3
InChIKeyYIHYNSLCJLCHIX-UHFFFAOYSA-N
MW116.20 g/mol
LogP2.40
Rot. Bonds

About cyclopropanone;ethane

cyclopropanone;ethane (PubChem CID 90860291) has the molecular formula C7H16O and a molecular weight of 116.20 g/mol. Its IUPAC name is cyclopropanone;ethane.

Molecular Properties

Compound Namecyclopropanone;ethane
PubChem CID90860291
Molecular FormulaC7H16O
Molecular Weight116.20 g/mol
Exact Mass116.12
IUPAC Namecyclopropanone;ethane
SMILESCC.CC.O=C1CC1
InChIInChI=1S/C3H4O.2C2H6/c4-3-1-2-3;2*1-2/h1-2H2;2*1-2H3
InChIKeyYIHYNSLCJLCHIX-UHFFFAOYSA-N
XLogP2.40
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.20
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopropanone;ethane?
The IUPAC name of cyclopropanone;ethane (CID 90860291) is cyclopropanone;ethane.
What is the SMILES notation for cyclopropanone;ethane?
The canonical SMILES for cyclopropanone;ethane is CC.CC.O=C1CC1.
What is the InChIKey of cyclopropanone;ethane?
The InChIKey is YIHYNSLCJLCHIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4O.2C2H6/c4-3-1-2-3;2*1-2/h1-2H2;2*1-2H3.
What are the key properties of cyclopropanone;ethane?
cyclopropanone;ethane has a molecular weight of 116.20 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropanone;ethane is sourced from PubChem (CID 90860291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).