2-methoxyethanol

C3H8O2 — CID 8019

IUPAC2-methoxyethanol
SMILESCOCCO
InChIInChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3
InChIKeyXNWFRZJHXBZDAG-UHFFFAOYSA-N
MW76.09 g/mol
LogP-0.37
Rot. Bonds2

About 2-methoxyethanol

2-methoxyethanol (PubChem CID 8019) has the molecular formula C3H8O2 and a molecular weight of 76.09 g/mol. Its IUPAC name is 2-methoxyethanol.

Molecular Properties

Compound Name2-methoxyethanol
PubChem CID8019
Molecular FormulaC3H8O2
Molecular Weight76.09 g/mol
Exact Mass76.05
IUPAC Name2-methoxyethanol
SMILESCOCCO
InChIInChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3
InChIKeyXNWFRZJHXBZDAG-UHFFFAOYSA-N
XLogP-0.37
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.09
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Diethylene Glycol Monomethyl Ether
CID 8134
Diethylene Glycol
CID 8117
Diethylene Glycol Monoethyl Ether
CID 8146
Glycol monoethyl ether
CID 8076
Glycol monopropyl ether
CID 17756
2-(2-ethoxyethoxy)ethan(2H)ol
CID 2723953
Ethanol, 2-methoxy-, ester with boric acid (H3BO3)
CID 176234
Di(ethylene glycol-d2)
CID 16213024
2-Methoxyethanol-13C3
CID 16213380
Di(ethylene-d8 glycol)
CID 71309368
Poly(ethylene glycol) dimethyl ether (NHD)
CID 445171
2-Ethoxyethanol-water
CID 16750101

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethanol?
The IUPAC name of 2-methoxyethanol (CID 8019) is 2-methoxyethanol.
What is the SMILES notation for 2-methoxyethanol?
The canonical SMILES for 2-methoxyethanol is COCCO.
What is the InChIKey of 2-methoxyethanol?
The InChIKey is XNWFRZJHXBZDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3.
What are the key properties of 2-methoxyethanol?
2-methoxyethanol has a molecular weight of 76.09 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethanol is sourced from PubChem (CID 8019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).