ethane;formaldehyde;methane;2-methoxyoxane

C14H36O3 — CID 161263277

IUPACethane;formaldehyde;methane;2-methoxyoxane
SMILESC.C=O.CC.CC.CC.COC1CCCCO1
InChIInChI=1S/C6H12O2.3C2H6.CH2O.CH4/c1-7-6-4-2-3-5-8-6;4*1-2;/h6H,2-5H2,1H3;3*1-2H3;1H2;1H4
InChIKeyVCVOWBOWKAEIIN-UHFFFAOYSA-N
MW252.44 g/mol
LogP4.69
Rot. Bonds1

About ethane;formaldehyde;methane;2-methoxyoxane

ethane;formaldehyde;methane;2-methoxyoxane (PubChem CID 161263277) has the molecular formula C14H36O3 and a molecular weight of 252.44 g/mol. Its IUPAC name is ethane;formaldehyde;methane;2-methoxyoxane.

Molecular Properties

Compound Nameethane;formaldehyde;methane;2-methoxyoxane
PubChem CID161263277
Molecular FormulaC14H36O3
Molecular Weight252.44 g/mol
Exact Mass252.27
IUPAC Nameethane;formaldehyde;methane;2-methoxyoxane
SMILESC.C=O.CC.CC.CC.COC1CCCCO1
InChIInChI=1S/C6H12O2.3C2H6.CH2O.CH4/c1-7-6-4-2-3-5-8-6;4*1-2;/h6H,2-5H2,1H3;3*1-2H3;1H2;1H4
InChIKeyVCVOWBOWKAEIIN-UHFFFAOYSA-N
XLogP4.69
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.44
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxyoxepane
CID 24974084
methoxycyclohexane;methoxycyclopentane;2-methoxyoxane;2-methoxyoxolane
CID 157095286
2-methoxyoxane;3-methyl-2-methylideneoxetane
CID 161197954
2-methoxy-6-methyl-6-[6-methyl-6-(oxonan-2-yloxy)oxecan-2-yl]oxyoxecane
CID 123438419
methane;N-(oxan-2-yloxy)methanimine
CID 159649356
2-[2-(oxan-2-yloxy)propan-2-yloxy]oxane
CID 18680583
dimethyl-methylidene-(oxan-2-yloxy)-λ5-iodane
CID 163749083
tris(oxan-2-yl) phosphate
CID 175007883
(2S,6S)-2-methoxy-6-[2-(oxan-2-yl)ethyl]oxane
CID 134833646
oxan-2-yl 2,2-dimethylpropanoate
CID 10679121
ethane;2-(oxan-2-yloxy)ethanol
CID 143259213
2-[(E)-prop-1-enoxy]oxane
CID 12835881

Frequently Asked Questions

What is the IUPAC name of ethane;formaldehyde;methane;2-methoxyoxane?
The IUPAC name of ethane;formaldehyde;methane;2-methoxyoxane (CID 161263277) is ethane;formaldehyde;methane;2-methoxyoxane.
What is the SMILES notation for ethane;formaldehyde;methane;2-methoxyoxane?
The canonical SMILES for ethane;formaldehyde;methane;2-methoxyoxane is C.C=O.CC.CC.CC.COC1CCCCO1.
What is the InChIKey of ethane;formaldehyde;methane;2-methoxyoxane?
The InChIKey is VCVOWBOWKAEIIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O2.3C2H6.CH2O.CH4/c1-7-6-4-2-3-5-8-6;4*1-2;/h6H,2-5H2,1H3;3*1-2H3;1H2;1H4.
What are the key properties of ethane;formaldehyde;methane;2-methoxyoxane?
ethane;formaldehyde;methane;2-methoxyoxane has a molecular weight of 252.44 g/mol, XLogP of 4.69, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;formaldehyde;methane;2-methoxyoxane is sourced from PubChem (CID 161263277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).