methoxymethane;propane-1,2-diol

C5H14O3 — CID 23435252

IUPACmethoxymethane;propane-1,2-diol
SMILESCC(O)CO.COC
InChIInChI=1S/C3H8O2.C2H6O/c1-3(5)2-4;1-3-2/h3-5H,2H2,1H3;1-2H3
InChIKeyJQKFLNWRTBPECK-UHFFFAOYSA-N
MW122.16 g/mol
LogP-0.38
Rot. Bonds1

About methoxymethane;propane-1,2-diol

methoxymethane;propane-1,2-diol (PubChem CID 23435252) has the molecular formula C5H14O3 and a molecular weight of 122.16 g/mol. Its IUPAC name is methoxymethane;propane-1,2-diol.

Molecular Properties

Compound Namemethoxymethane;propane-1,2-diol
PubChem CID23435252
Molecular FormulaC5H14O3
Molecular Weight122.16 g/mol
Exact Mass122.09
IUPAC Namemethoxymethane;propane-1,2-diol
SMILESCC(O)CO.COC
InChIInChI=1S/C3H8O2.C2H6O/c1-3(5)2-4;1-3-2/h3-5H,2H2,1H3;1-2H3
InChIKeyJQKFLNWRTBPECK-UHFFFAOYSA-N
XLogP-0.38
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.16
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

sodium;hydride;methoxymethane;propane-1,2-diol
CID 174416744
propane-1,2-diol
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CID 160650971
CID 160650971
propane-1,2-diol;silver
CID 158521790
1,2-dimethoxyethane;propane-1,2-diol
CID 87359366
acetic acid;methanol;methoxymethane;propane-1,2-diol
CID 174829154
propane-1,2-diol;trihydrochloride;dihydrofluoride
CID 174772875
methanol;propane-1,2-diol;hydrochloride
CID 88632623
CID 158929584
CID 158929584
hydroxymethoxymethanol;propane-1,2-diol
CID 87307826
chloroform;propane-1,2-diol
CID 159626759
propane-1,2-diol;1,1,2,2-tetrafluoroethene
CID 174777178

Frequently Asked Questions

What is the IUPAC name of methoxymethane;propane-1,2-diol?
The IUPAC name of methoxymethane;propane-1,2-diol (CID 23435252) is methoxymethane;propane-1,2-diol.
What is the SMILES notation for methoxymethane;propane-1,2-diol?
The canonical SMILES for methoxymethane;propane-1,2-diol is CC(O)CO.COC.
What is the InChIKey of methoxymethane;propane-1,2-diol?
The InChIKey is JQKFLNWRTBPECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O2.C2H6O/c1-3(5)2-4;1-3-2/h3-5H,2H2,1H3;1-2H3.
What are the key properties of methoxymethane;propane-1,2-diol?
methoxymethane;propane-1,2-diol has a molecular weight of 122.16 g/mol, XLogP of -0.38, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;propane-1,2-diol is sourced from PubChem (CID 23435252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).