Cas no 1261445-13-9 (2-methyl-5-(trifluoromethoxy)benzoyl Chloride)

2-Methyl-5-(trifluoromethoxy)benzoyl chloride is a versatile acyl chloride derivative used primarily as an intermediate in organic synthesis. Its key structural features include a reactive benzoyl chloride group and a trifluoromethoxy substituent, which enhance its utility in introducing trifluoromethoxy-containing moieties into target molecules. The compound is particularly valued in pharmaceutical and agrochemical research for its ability to participate in Friedel-Crafts acylation and other electrophilic reactions. The trifluoromethoxy group contributes to improved metabolic stability and lipophilicity in derived compounds. Handling requires standard precautions for acyl chlorides, including moisture-free conditions. Its well-defined reactivity profile makes it a reliable reagent for constructing complex molecular architectures.
2-methyl-5-(trifluoromethoxy)benzoyl Chloride structure
1261445-13-9 structure
Product Name:2-methyl-5-(trifluoromethoxy)benzoyl Chloride
CAS No:1261445-13-9
MF:C9H6ClF3O2
MW:238.590952396393
MDL:MFCD18399758
CID:1219538
PubChem ID:58342060
Update Time:2025-05-27

2-methyl-5-(trifluoromethoxy)benzoyl Chloride Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-5-(trifluoromethoxy)benzoyl Chloride
    • 2-methyl-5-(trifluoromethoxy)benzoylchloride
    • SCHEMBL12422194
    • 1261445-13-9
    • JS-5062
    • MFCD18399758
    • AKOS026670904
    • DWHYIYNVPCGCJQ-UHFFFAOYSA-N
    • MDL： MFCD18399758
    • Inchi： 1S/C9H6ClF3O2/c1-5-2-3-6(15-9(11,12)13)4-7(5)8(10)14/h2-4H,1H3
    • InChI Key： DWHYIYNVPCGCJQ-UHFFFAOYSA-N
    • SMILES： ClC(C1C=C(C=CC=1C)OC(F)(F)F)=O

Computed Properties

  • Exact Mass: 238.0008416g/mol
  • Monoisotopic Mass: 238.0008416g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 242
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4
  • Topological Polar Surface Area: 26.3?2

2-methyl-5-(trifluoromethoxy)benzoyl Chloride Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
M108370-500mg
2-Methyl-5-(trifluoromethoxy)benzoyl chloride
 1261445-13-9
500mg
 $ 140.00 2022-06-04
TRC
M108370-1000mg
2-Methyl-5-(trifluoromethoxy)benzoyl chloride
 1261445-13-9
1g
 $ 235.00 2022-06-04
Apollo Scientific
PC302819-1g
2-Methyl-5-(trifluoromethoxy)benzoyl chloride
 1261445-13-9 97%
1g
 ￡46.00 2025-02-21
Apollo Scientific
PC302819-5g
2-Methyl-5-(trifluoromethoxy)benzoyl chloride
 1261445-13-9 97%
5g
 ￡140.00 2025-02-21
Apollo Scientific
PC302819-10g
2-Methyl-5-(trifluoromethoxy)benzoyl chloride
 1261445-13-9 97%
10g
 ￡248.00 2025-02-21
abcr
AB350136-5 g
2-Methyl-5-(trifluoromethoxy)benzoyl chloride, 97%; .
 1261445-13-9 97%
5g
 €289.20 2023-04-26
abcr
AB350136-10 g
2-Methyl-5-(trifluoromethoxy)benzoyl chloride, 97%; .
 1261445-13-9 97%
10g
 €481.40 2023-04-26
Alichem
A013002178-250mg
2-Methyl-5-(trifluoromethoxy)benzoyl chloride
 1261445-13-9 97%
250mg
 $504.00 2023-09-03
Alichem
A013002178-500mg
2-Methyl-5-(trifluoromethoxy)benzoyl chloride
 1261445-13-9 97%
500mg
 $855.75 2023-09-03
Alichem
A013002178-1g
2-Methyl-5-(trifluoromethoxy)benzoyl chloride
 1261445-13-9 97%
1g
 $1460.20 2023-09-03

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