Cas no 1804889-28-8 (2,6-Bis(trifluoromethyl)-3-formylbenzoic acid)

2,6-Bis(trifluoromethyl)-3-formylbenzoic acid structure
1804889-28-8 structure
Product Name:2,6-Bis(trifluoromethyl)-3-formylbenzoic acid
CAS No:1804889-28-8
MF:C10H4F6O3
MW:286.127384185791
CID:4794112
Update Time:2023-08-17

2,6-Bis(trifluoromethyl)-3-formylbenzoic acid Chemical and Physical Properties

Names and Identifiers

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

2,6-Bis(trifluoromethyl)-3-formylbenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A014000744-1g
2,6-Bis(trifluoromethyl)-3-formylbenzoic acid
1804889-28-8 97%
1g
1,549.60 USD 2021-05-31
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