ethene;methanol

C6H16O2 — CID 159120988

IUPACethene;methanol
SMILESC=C.C=C.CO.CO
InChIInChI=1S/2C2H4.2CH4O/c4*1-2/h2*1-2H2;2*2H,1H3
InChIKeyKFRPJTXWEDCKKR-UHFFFAOYSA-N
MW120.19 g/mol
LogP0.82
Rot. Bonds

About ethene;methanol

ethene;methanol (PubChem CID 159120988) has the molecular formula C6H16O2 and a molecular weight of 120.19 g/mol. Its IUPAC name is ethene;methanol.

Molecular Properties

Compound Nameethene;methanol
PubChem CID159120988
Molecular FormulaC6H16O2
Molecular Weight120.19 g/mol
Exact Mass120.12
IUPAC Nameethene;methanol
SMILESC=C.C=C.CO.CO
InChIInChI=1S/2C2H4.2CH4O/c4*1-2/h2*1-2H2;2*2H,1H3
InChIKeyKFRPJTXWEDCKKR-UHFFFAOYSA-N
XLogP0.82
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.19
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethene;methanol?
The IUPAC name of ethene;methanol (CID 159120988) is ethene;methanol.
What is the SMILES notation for ethene;methanol?
The canonical SMILES for ethene;methanol is C=C.C=C.CO.CO.
What is the InChIKey of ethene;methanol?
The InChIKey is KFRPJTXWEDCKKR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H4.2CH4O/c4*1-2/h2*1-2H2;2*2H,1H3.
What are the key properties of ethene;methanol?
ethene;methanol has a molecular weight of 120.19 g/mol, XLogP of 0.82, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;methanol is sourced from PubChem (CID 159120988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).