2-methoxyethanol;methyl hydrogen carbonate

C5H12O5 — CID 160714037

IUPAC2-methoxyethanol;methyl hydrogen carbonate
SMILESCOC(=O)O.COCCO
InChIInChI=1S/C3H8O2.C2H4O3/c1-5-3-2-4;1-5-2(3)4/h4H,2-3H2,1H3;1H3,(H,3,4)
InChIKeyRSFRXQKHBSYQRE-UHFFFAOYSA-N
MW152.15 g/mol
LogP-0.06
Rot. Bonds2

About 2-methoxyethanol;methyl hydrogen carbonate

2-methoxyethanol;methyl hydrogen carbonate (PubChem CID 160714037) has the molecular formula C5H12O5 and a molecular weight of 152.15 g/mol. Its IUPAC name is 2-methoxyethanol;methyl hydrogen carbonate.

Molecular Properties

Compound Name2-methoxyethanol;methyl hydrogen carbonate
PubChem CID160714037
Molecular FormulaC5H12O5
Molecular Weight152.15 g/mol
Exact Mass152.07
IUPAC Name2-methoxyethanol;methyl hydrogen carbonate
SMILESCOC(=O)O.COCCO
InChIInChI=1S/C3H8O2.C2H4O3/c1-5-3-2-4;1-5-2(3)4/h4H,2-3H2,1H3;1H3,(H,3,4)
InChIKeyRSFRXQKHBSYQRE-UHFFFAOYSA-N
XLogP-0.06
TPSA75.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,2-dimethoxyethane;ethane-1,2-diol;tris(2-methoxyethanol)
CID 160893759
sodium 2-methoxyethanol
CID 21124383
2-methoxyethanol;sulfane
CID 174965249
bismuthane;2-methoxyethanol
CID 174782924
ethane;2-methoxyethanol
CID 175109361
bis(1-hydroxypropan-2-one);2-methoxyethanol
CID 88639054
2-methoxyethanol;prop-2-enoic acid;titanium
CID 22899396
ethane-1,2-diol;2-methoxyethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 161198801
2-methoxyethanol;2-(2-methoxyethoxy)ethanol
CID 87975598
dimethylsilane;2-methoxyethanol
CID 174782781
sodium;methanolate;2-methoxyethanol
CID 88740806
carbonic acid;methyl hydrogen carbonate
CID 175554276

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethanol;methyl hydrogen carbonate?
The IUPAC name of 2-methoxyethanol;methyl hydrogen carbonate (CID 160714037) is 2-methoxyethanol;methyl hydrogen carbonate.
What is the SMILES notation for 2-methoxyethanol;methyl hydrogen carbonate?
The canonical SMILES for 2-methoxyethanol;methyl hydrogen carbonate is COC(=O)O.COCCO.
What is the InChIKey of 2-methoxyethanol;methyl hydrogen carbonate?
The InChIKey is RSFRXQKHBSYQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O2.C2H4O3/c1-5-3-2-4;1-5-2(3)4/h4H,2-3H2,1H3;1H3,(H,3,4).
What are the key properties of 2-methoxyethanol;methyl hydrogen carbonate?
2-methoxyethanol;methyl hydrogen carbonate has a molecular weight of 152.15 g/mol, XLogP of -0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethanol;methyl hydrogen carbonate is sourced from PubChem (CID 160714037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).