Methoxyacetic acid
Properties
- Molecular formula
- C3H6O3
- Molar mass
- 90.08 g/mol
- Exact mass
- 90.0317 Da
- Density
- 1.177 g/mL (at 20 °C)
- Melting point
- 7.7 °C
- Boiling point
- 203.5 °C
- Flash point
- 112.8 °C
- Water solubility
- ≥ 100 g/L (18.9 °C)
- logP
- -0.28Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 2
Hazards
Danger
- H302 Harmful if swallowedAcute toxicity, oral
- H314 Causes severe skin burns and eye damageSkin corrosion/irritation
- H360FD May damage fertility; May damage the unborn childReproductive toxicity
Harmonised EU classification (CLP Annex VI, index 607-312-00-1), via PubChem.
Precautionary statements
P203, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P318, P321, P330, P363, P405, P501
Identifiers
CAS number
625-45-6SMILES
COCC(=O)OInChIKey
RMIODHQZRUFFFF-UHFFFAOYSA-NInChI
InChI=1S/C3H6O3/c1-6-2-3(4)5/h2H2,1H3,(H,4,5)Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Acetic acid, 2-methoxy-
- Acetic acid, methoxy-
- 2-Methoxyacetic acid
- Methoxyethanoic acid
- NSC 7300
Work with Methoxyacetic acid
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
(2-Methoxyethoxy)acetic acid16024-56-964 % similar
(2-(2-Methoxyethoxy)ethoxy)acetic acid16024-58-162 % similar
2,5,8,11-Tetraoxatridecan-13-oic acid16024-60-562 % similar
Diglycolic acid110-99-657 % similar
2,2′-[1,2-Ethanediylbis(oxy)]bis[acetic acid]23243-68-752 % similar
Polyethylene glycol bis(carboxymethyl) ether39927-08-752 % similar
Acetoxyacetic acid13831-30-652 % similar
Ethoxyacetic acid627-03-252 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.