Cas no 842971-74-8 (3-Formyl-5-methyl-1H-indole-2-carboxylic acid)

3-Formyl-5-methyl-1H-indole-2-carboxylic acid structure
842971-74-8 structure
Product Name:3-Formyl-5-methyl-1H-indole-2-carboxylic acid
CAS No:842971-74-8
MF:C11H9NO3
MW:203.194062948227
MDL:MFCD06800773
CID:716268
PubChem ID:3159583
Update Time:2025-04-19

3-Formyl-5-methyl-1H-indole-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Formyl-5-methyl-1H-indole-2-carboxylic acid
    • 1H-Indole-2-carboxylicacid, 3-formyl-5-methyl-
    • 3-formyl-5-methyl-1H-indole-2-carboxylic acid(SALTDATA: FREE)
    • SY079335
    • MFCD06800773
    • 2-Carboxy-5-methylindol-3-aldehyd
    • DTXSID40390179
    • CS-0374034
    • 3-formyl-5-methylindole-2-carboxylic acid
    • EN300-317767
    • 3-formyl-5-methyl-1H-indole-2-carboxylicacid
    • Z1203159769
    • 3-Formyl-5-methyl-1H-indole-2-carboxylic acid, AldrichCPR
    • AKOS000302669
    • VS-03367
    • SR-01000368654-1
    • 842971-74-8
    • SR-01000368654
    • MDL： MFCD06800773
    • Inchi： 1S/C11H9NO3/c1-6-2-3-9-7(4-6)8(5-13)10(12-9)11(14)15/h2-5,12H,1H3,(H,14,15)
    • InChI Key： BMVNZBKQRRYJSV-UHFFFAOYSA-N
    • SMILES： OC(C1=C(C=O)C2C=C(C)C=CC=2N1)=O

Computed Properties

  • Exact Mass: 203.058
  • Monoisotopic Mass: 203.058
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 279
  • 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
  • Topological Polar Surface Area: 70.2A^2
  • XLogP3: 1.7

Experimental Properties

  • Density: 1.427
  • Boiling Point: 480.8°C at 760 mmHg
  • Flash Point: 244.6°C
  • Refractive Index: 1.733
  • PSA: 70.16000
  • LogP: 1.98700

3-Formyl-5-methyl-1H-indole-2-carboxylic acid Security Information

  • Hazardous Material Identification： Xi
  • HazardClass：IRRITANT

3-Formyl-5-methyl-1H-indole-2-carboxylic acid Pricemore >>

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