Cas no 1807111-52-9 (3,4-Bis(trifluoromethyl)-2-formylbenzoic acid)

3,4-Bis(trifluoromethyl)-2-formylbenzoic acid structure
1807111-52-9 structure
Product Name:3,4-Bis(trifluoromethyl)-2-formylbenzoic acid
CAS No:1807111-52-9
MF:C10H4F6O3
MW:286.127384185791
CID:4794107
Update Time:2023-08-17

3,4-Bis(trifluoromethyl)-2-formylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3,4-Bis(trifluoromethyl)-2-formylbenzoic acid
    • Inchi: 1S/C10H4F6O3/c11-9(12,13)6-2-1-4(8(18)19)5(3-17)7(6)10(14,15)16/h1-3H,(H,18,19)
    • InChI Key: MKROSWULFJQPJR-UHFFFAOYSA-N
    • SMILES: FC(C1C(C=O)=C(C(=O)O)C=CC=1C(F)(F)F)(F)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 361
  • XLogP3: 2.7
  • Topological Polar Surface Area: 54.4

3,4-Bis(trifluoromethyl)-2-formylbenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A014000745-1g
3,4-Bis(trifluoromethyl)-2-formylbenzoic acid
1807111-52-9 97%
1g
1,564.50 USD 2021-05-31
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