CAS Number2568-33-4
SynonymsIsopentyldiol; 3-hydroxy-3-methylbutanol; 3-Methylbutane-1,3-diol; 3-methyl-butane-1,3-diol; MFCD00059655; 1,3-Butanediol,3-methyl; 3-METHYL-1,3-BUTANEDIOL; 1,1-dimethyl-1,3-propanediol; 2-Methyl-2,4-butanediol; UNII-19NOL5474Q; (S)-2-isobutyl-4,4-dimethyl-1,3-dioxane
Molecular FormulaC5H12O2
Molecular Weight104.148
Density1.0±0.1 g/cm3
Boiling Point201.0±8.0 °C at 760 mmHg
Melting Point50.86°C (estimate)
AppearanceTransparent colorless liquid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 2568-33-4 |
| Catalog No. | 2A-1174461 |
| Chinese Name | 3-甲基-1,3-丁二醇 |
| Synonyms | Isopentyldiol; 3-hydroxy-3-methylbutanol; 3-Methylbutane-1,3-diol; 3-methyl-butane-1,3-diol; MFCD00059655; 1,3-Butanediol,3-methyl; 3-METHYL-1,3-BUTANEDIOL; 1,1-dimethyl-1,3-propanediol; 2-Methyl-2,4-butanediol; UNII-19NOL5474Q; (S)-2-isobutyl-4,4-dimethyl-1,3-dioxane |
| Molecular Formula | C5H12O2 |
| Molecular Weight | 104.148 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 201.0±8.0 °C at 760 mmHg |
| Melting Point | 50.86°C (estimate) |
| Appearance | Transparent colorless liquid |
| Water Solubility | Water solubility: completely miscible; soluble in: |
| Storage Condition | Sealed in a cool, dry environment. |
| HTC | 29053995 |
| PubChem ID | 109380 |
| SMILES | CC(C)(O)CCO |
| InChI | InChI=1S/C5H12O2/c1-5(2,7)3-4-6/h6-7H,3-4H2,1-2H3 |
| InChI Key | XPFCZYUVICHKDS-UHFFFAOYSA-N |
| MSDS | msds/174814_2_2568_33_4.pdf |
| Transport Info | Product name: Purity: 0.0% |
| MSDS Transport Info | Module 14. Shipping information United Nations classification: inconsistent with United Nations classification standards UN number: not specified |
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