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1,3-Dichloroacetone, 96%

Product Code. 11409080
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Product Code. 11409080

Brand: Thermo Scientific Alfa Aesar A14149.14

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CAS: 534-07-6 | C3H4Cl2O | 126.96 g/mol

1,3-Dichloroacetone is used in the synthesis of citric acid. It is used as a solvent and as an intermediate in organic synthesis. Further, it serves as an acceptor substrate in the cross-aldol reaction with donor substrates such as acetone, cyclopentanone and cyclohexanone. It is also used in the preparation of an active pharmaceutical ingredient, famotidine.

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.

Applications
1,3-Dichloroacetone is used in the synthesis of citric acid. It is used as a solvent and as an intermediate in organic synthesis. Further, it serves as an acceptor substrate in the cross-aldol reaction with donor substrates such as acetone, cyclopentanone and cyclohexanone. It is also used in the preparation of an active pharmaceutical ingredient, famotidine.

Solubility
Soluble in water, ethanol and diethyl ether.

Notes
Hygroscopic. Store in a cool place. Incompatible with strong oxidizing agents, strong bases and reducing agents.
TRUSTED_SUSTAINABILITY

Chemical Identifiers

CAS 534-07-6
Molecular Formula C3H4Cl2O
Molecular Weight (g/mol) 126.96
MDL Number MFCD00000937
InChI Key SUNMBRGCANLOEG-UHFFFAOYSA-N
Synonym 1,3-dichloroacetone, 1,3-dichloro-2-propanone, 1,3-dichloropropanone, s-dichloroacetone, sym-dichloroacetone, bis chloromethyl ketone, 2-propanone, 1,3-dichloro, acetone, 1,3-dichloro, chloromethyl ketone
PubChem CID 10793
IUPAC Name 1,3-dichloropropan-2-one
SMILES ClCC(=O)CCl

Specifications

Melting Point 40°C to 44°C
Density 1.383
pH 4.2
Boiling Point 172°C to 173°C
Flash Point 95°C (203°F)
Odor Pungent
Refractive Index 1.44
Quantity 25 g
UN Number UN2649
Beilstein 605456
Merck Index 14,3052
Solubility Information Soluble in water,ethanol and diethyl ether.
Formula Weight 126.97
Percent Purity 96%
Chemical Name or Material 1,3-Dichloroacetone
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Signal Word
  • Danger
Hazard Category
  • Acute toxicity Category 1
  • Acute toxicity Category 2
  • Acute toxicity Category 3
  • Serious eye damage/eye irritation Category 1
  • Germ cell mutagenicity Category 2
  • Skin corrosion/irritation Category 1 B
Hazard Statement
  • H300-Fatal if swallowed.
  • H311-Toxic in contact with skin.
  • H314-Causes severe skin burns and eye damage.
  • H318-Causes serious eye damage.
  • H330-Fatal if inhaled.
  • H341-Suspected of causing genetic defects.
Precautionary Statement
  • P280-Wear protective gloves/protective clothing/eye protection/face protection.
  • P301+P330+P331-IF SWALLOWED: rinse mouth. Do NOT induce vomiting.
  • P303+P361+P353-IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/ shower.
  • P304+P340-IF INHALED: Remove person to fresh air and keep comfortable for breathing.
  • P305+P351+P338-IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P310-Immediately call a POISON CENTER/doctor/.

RUO – Research Use Only

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