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1,1,1-Trichloro-2-methyl-2-propanol hemihydrate, 98%
CAS: 6001-64-5 | C4H11Cl3O2 | 197.48 g/mol
$58.78 - $178.30
Chemical Identifiers
| CAS | 6001-64-5 |
|---|---|
| Molecular Formula | C4H11Cl3O2 |
| Molecular Weight (g/mol) | 197.48 |
| MDL Number | MFCD00004461 |
| InChI Key | HBARVHNVVKZUGS-UHFFFAOYSA-N |
| Synonym | c4h7cl3o.1/2h2o, 1,1,1-trichloro-2-methyl-2-propanol hemihydrate, chlorobutanol hydrogen ion hydrate |
| PubChem CID | 102594540 |
| IUPAC Name | molecular hydrogen;1,1,1-trichloro-2-methylpropan-2-ol;hydrate |
| SMILES | [HH].CC(C)(C(Cl)(Cl)Cl)O.O |
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
|---|---|---|---|---|---|---|---|---|---|
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
|
AAA1018114
|
Thermo Scientific Chemicals
A1018114 |
25 g |
N/A
|
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|
AAA1018122
|
Thermo Scientific Chemicals
A1018122 |
100 g |
N/A
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Description
1,1,1-Trichloro-2-methyl-2-propanol hemihydrate converts benzisoxazole to α-aryloxyisobutyric acid. It forms eutectic with dimethyl sulfone, which is the most suitable media for freeze-drying due to its high solubilizing ability and a good rate of solvent removal.
This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.
Applications1,1,1-Trichloro-2-methyl-2-propanol hemihydrate converts benzisoxazole to α-aryloxyisobutyric acid. It forms eutectic with dimethyl sulfone, which is the most suitable media for freeze-drying due to its high solubilizing ability and a good rate of solvent removal.
Solubility
Soluble in ethanol, ether, chloroform, and glycerol. Insoluble in water.
Notes
Incompatible with oxidizing agents. Store in a cool, dry condition in well sealed containers.
Chemical Identifiers
| 6001-64-5 | |
| 197.48 | |
| HBARVHNVVKZUGS-UHFFFAOYSA-N | |
| 102594540 | |
| [HH].CC(C)(C(Cl)(Cl)Cl)O.O |
| C4H11Cl3O2 | |
| MFCD00004461 | |
| c4h7cl3o.1/2h2o, 1,1,1-trichloro-2-methyl-2-propanol hemihydrate, chlorobutanol hydrogen ion hydrate | |
| molecular hydrogen;1,1,1-trichloro-2-methylpropan-2-ol;hydrate |
Specifications
| 6001-64-5 | |
| 167°C | |
| C4H11Cl3O2 | |
| 25 g | |
| 14,2129 | |
| Soluble in ethanol,ether,chloroform,and glycerol. Insoluble in water. | |
| [HH].CC(C)(C(Cl)(Cl)Cl)O.O | |
| 197.48 | |
| 186.47 (177.46 Anhydrous) | |
| 1,1,1-Trichloro-2-methyl-2-propanol hemihydrate |
| 98°C to 100°C (anhydrous) | |
| >100°C (212°F) | |
| MFCD00004461 | |
| 878167 | |
| c4h7cl3o.1/2h2o, 1,1,1-trichloro-2-methyl-2-propanol hemihydrate, chlorobutanol hydrogen ion hydrate | |
| HBARVHNVVKZUGS-UHFFFAOYSA-N | |
| molecular hydrogen;1,1,1-trichloro-2-methylpropan-2-ol;hydrate | |
| 102594540 | |
| 98% |
Safety and Handling
GHS H Statement
H302
Harmful if swallowed.
P261-P264b-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P362-P501c
H302-H315-H319-H335
EINECSNumber : 200-317-6
RTECSNumber : UC0175000
TSCA : Yes
Recommended Storage : Ambient temperatures
RUO – Research Use Only