Basic information
- CAS
14236-12-5- Standard SMILES
OCC1COC(CO)CO1- InChIKey
WHRYYSSZMQDPLV-UHFFFAOYSA-N- Molecular formula
- C6H12O4
- Average molar mass
- 148.16 g/mol
- Monoisotopic mass
- 148.07355886
Names & identifiers
- Preferred name
- 1,4-Dioxane-2,5-dimethanol
- IUPAC
- [5-(hydroxymethyl)-1,4-dioxan-2-yl]methanol
- English name
- p-Dioxane-2,5-dimethanol
- Molecular formula
- C6H12O4
- Molecular weight
- 148.16
Names & synonyms
14236-12-51,4-Dioxane-2,5-dimethanolp-Dioxane-2,5-dimethanolDTXSID10337859RefChem:220740DTXCID40288946WHRYYSSZMQDPLV-UHFFFAOYSA-N(1,4-Dioxane-2,5-diyl)dimethanol[5-(hydroxymethyl)-1,4-dioxan-2-yl]methanolMFCD24503997Bis(2,5-hydroxymethyl)dioxaneGlycerol Impurity N4
Show more names
1,4-Dioxane-2,5-bismethanol5-(hydroxymethyl)-1,4-dioxan-2-yl]methanolGlycerol Impurity 7 (Mixture of Diastereomers)Glycerol Impurity 4 (Mixture of Diastereomers)Bis(2,5-hydroxymethyl)dioxane(Mixture of Diastereomers)Bis(2,5-hydroxymethyl)dioxane\n(Mixture of Diastereomers)
SCHEMBL2423981,4-Dioxane-2,5-diyldimethanolAC8215AKOS030255422FD45697SY263372DB-225968CS-0446081
Database identifiers
- CAS
14236-12-5- PubChem CID
- 545145
- DTXSID
DTXSID10337859- Nikkaji
- J25.352I
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 83.7
Physicochemical properties
- Melting point
- 91 · 91-93°C
- Boiling point
- 294.2 · 294.2±15.0 °C(Predicted)
- Density
- 1.178 · 1.178±0.06 g/cm3(Predicted)
- storage temp.
- Refrigerator, Under Inert Atmosphere
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 13.94 · 13.94±0.10(Predicted)
- color
- White
Chemistry & industry
Applications
UsesA component in beef flavoring. A derivative of dioxane.
Suppliers15 total
济南百隆化学有限公司[email protected] · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
南京望知星医药科技有限公司18569809817 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
河南伊诺凯新材料有限公司15670530983 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
南京华诺生物医药科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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