ethane;formaldehyde;2-methyloxolane

C8H18O2 — CID 145378358

IUPACethane;formaldehyde;2-methyloxolane
SMILESC=O.CC.CC1CCCO1
InChIInChI=1S/C5H10O.C2H6.CH2O/c1-5-3-2-4-6-5;2*1-2/h5H,2-4H2,1H3;1-2H3;1H2
InChIKeyVNFMISROHJMUSE-UHFFFAOYSA-N
MW146.23 g/mol
LogP2.03
Rot. Bonds

About ethane;formaldehyde;2-methyloxolane

ethane;formaldehyde;2-methyloxolane (PubChem CID 145378358) has the molecular formula C8H18O2 and a molecular weight of 146.23 g/mol. Its IUPAC name is ethane;formaldehyde;2-methyloxolane.

Molecular Properties

Compound Nameethane;formaldehyde;2-methyloxolane
PubChem CID145378358
Molecular FormulaC8H18O2
Molecular Weight146.23 g/mol
Exact Mass146.13
IUPAC Nameethane;formaldehyde;2-methyloxolane
SMILESC=O.CC.CC1CCCO1
InChIInChI=1S/C5H10O.C2H6.CH2O/c1-5-3-2-4-6-5;2*1-2/h5H,2-4H2,1H3;1-2H3;1H2
InChIKeyVNFMISROHJMUSE-UHFFFAOYSA-N
XLogP2.03
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;formaldehyde;2-methyloxolane?
The IUPAC name of ethane;formaldehyde;2-methyloxolane (CID 145378358) is ethane;formaldehyde;2-methyloxolane.
What is the SMILES notation for ethane;formaldehyde;2-methyloxolane?
The canonical SMILES for ethane;formaldehyde;2-methyloxolane is C=O.CC.CC1CCCO1.
What is the InChIKey of ethane;formaldehyde;2-methyloxolane?
The InChIKey is VNFMISROHJMUSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O.C2H6.CH2O/c1-5-3-2-4-6-5;2*1-2/h5H,2-4H2,1H3;1-2H3;1H2.
What are the key properties of ethane;formaldehyde;2-methyloxolane?
ethane;formaldehyde;2-methyloxolane has a molecular weight of 146.23 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;formaldehyde;2-methyloxolane is sourced from PubChem (CID 145378358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).