2,2-Bis(hydroxymethyl)propionic acid
2,2-Bis(hydroxymethyl)propionic acid Structure
Systematic / IUPAC Name: 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid
ID: Reference3259
Other Names:
α,α-Bis(hydroxymethyl)propionic acid;
2,2-Bis(hydroxymethyl)propanoic acid;
2,2-Bis(methylol)propionic acid;
2,2-Dihydroxymethylpropanoic acid;
2,2-Dimethylolpropionic acid
; more
Formula: C5H10O4
Class: Extractables/Leachables Industrial Chemicals Endogenous Metabolites Textile Chemicals/Auxiliary/Dyes
Spectral Data
2,2-Bis(hydroxymethyl)propionic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 107 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 11/6/2015 7:00:04 AM |
Identificators
| InChI | InChI=1S/C5H10O4/c1-5(2-6,3-7)4(8)9/h6-7H,2-3H2,1H3,(H,8,9) |
| InChI Key | PTBDIHRZYDMNKB-UHFFFAOYSA-N |
| Canonical SMILES | CC(CO)(CO)C(=O)O |
| CAS | 4767037 |
| Splash | |
| Other Names |
α,α-Bis(hydroxymethyl)propionic acid; 2,2-Bis(hydroxymethyl)propanoic acid; 2,2-Bis(methylol)propionic acid; 2,2-Dihydroxymethylpropanoic acid; 2,2-Dimethylolpropionic acid; 3-Hydroxy-2-hydroxymethyl-2-methyl-propionic acid; Bis(hydroxymethyl)propionic acid; Dimethylolpropionic acid; Hydracrylic acid, 2-(hydroxymethyl)-2-methyl-; Propanoic acid, 3-hydroxy-2-(hydroxymethyl)-2-methyl-; Propionic acid, 2,2-bis(hydroxymethyl)- |
In Other Databases
| PubChem | 78501 |
| ChemSpider | 70865 |
| ChemIDPlus | 004767037 |
| ChEMBL | CHEMBL3183172 |