WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 559343
CAS#: 532-27-4
Description: omega-Chloroacetophenone is a riot control agent. Chiral 1-(o-chlorophenyl)-ethanols are key intermediates in the synthesis of chemotherapeutic substances. Enantioselective reduction of o-chloroacetophenone is a preferred method of production but well investigated chemo- and biocatalysts for this transformation are currently lacking.
MedKoo Cat#: 559343
Name: omega-Chloroacetophenone
CAS#: 532-27-4
Chemical Formula: C8H7ClO
Exact Mass: 154.0185
Molecular Weight: 154.59
Elemental Analysis: C, 62.16; H, 4.56; Cl, 22.93; O, 10.35
This product is not in stock, which may be available by custom synthesis.
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Synonym: omega-Chloroacetophenone; AI3-52322; BRN 0507950; CCRIS 2370; EINECS 208-531-1; HSDB 972; NCI-C55107; NSC 41666; AI3 52322; BRN0507950; CCRIS2370; EINECS208-531-1; HSDB972; NCI C55107; NSC41666
IUPAC/Chemical Name: 2-Chloroacetophenone
InChi Key: IMACFCSSMIZSPP-UHFFFAOYSA-N
InChi Code: InChI=1S/C8H7ClO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H,6H2
SMILES Code: ClCC(=O)c1ccccc1
Appearance: Solid powder
Purity: >98% (or refer to the Certificate of Analysis)
Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility: To be determined
Shelf Life: >2 years if stored properly
Drug Formulation: To be determined
Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code: 2934.99.9001
The following data is based on the product molecular weight 154.59 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass | 1 mg | 5 mg | 10 mg |
|---|---|---|---|
| 1 mM | 1.15 mL | 5.76 mL | 11.51 mL |
| 5 mM | 0.23 mL | 1.15 mL | 2.3 mL |
| 10 mM | 0.12 mL | 0.58 mL | 1.15 mL |
| 50 mM | 0.02 mL | 0.12 mL | 0.23 mL |
Kratzer R, Pukl M, Egger S, Vogl M, Brecker L, Nidetzky B. Enzyme identification and development of a whole-cell biotransformation for asymmetric reduction of o-chloroacetophenone. Biotechnol Bioeng. 2011 Apr;108(4):797-803. doi: 10.1002/bit.23002. Epub 2010 Nov 26. PMID: 21404254.
