Cas no 16264-71-4 (1H-Indole-2-carboxylicacid, 1-hydroxy-)
16264-71-4 structure
Product Name:1H-Indole-2-carboxylicacid, 1-hydroxy-
CAS No:16264-71-4
MF:C9H7NO3
MW:177.156782388687
CID:121535
PubChem ID:21194199
Update Time:2025-04-18
1H-Indole-2-carboxylicacid, 1-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-2-carboxylicacid, 1-hydroxy-
- 1H-Indole-2-carboxylicacid,1-hydroxy-(9CI)
- 1-hydroxyindole-2-carboxylic acid
- SCHEMBL7561
- CHEMBL3617314
- DTXSID00611291
- DPTNMLUPFDKDAJ-UHFFFAOYSA-N
- 1-hydroxy-1H-indole-2-carboxylicacid
- 16264-71-4
- 1-hydroxy-1H-indole-2-carboxylic acid
- 1-hydroxy-2-indolecarboxylic acid
- NSC-826890
- AKOS024385015
- BDBM50122008
- NSC826890
-
- Inchi： 1S/C9H7NO3/c11-9(12)8-5-6-3-1-2-4-7(6)10(8)13/h1-5,13H,(H,11,12)
- InChI Key： DPTNMLUPFDKDAJ-UHFFFAOYSA-N
- SMILES： ON1C(C(=O)O)=CC2C=CC=CC1=2
Computed Properties
- Exact Mass: 177.04261
- Monoisotopic Mass: 177.042593085g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 219
- 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: 2.6
- Topological Polar Surface Area: 62.5?2
Experimental Properties
- PSA: 62.46
1H-Indole-2-carboxylicacid, 1-hydroxy- Related Literature
-
1. The tautomerism and bromination of some 1-hydroxyindole-2-carboxylic acid derivativesR. M. Acheson,C. J. Q. Brookes,D. P. Dearnaley,B. Quest J. Chem. Soc. C 1968 504
-
2. Catalytic hydrogenation of some derivatives of 2-nitrophenylpyruvic acidI. Baxter,G. A. Swan J. Chem. Soc. C 1967 2446
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4. 171. Studies in the indole series. Part III. Improved synthesis of tryptophanJ. Elks,D. F. Elliott,B. A. Hems J. Chem. Soc. 1944 629
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R. F. Chapman,G. A. Swan J. Chem. Soc. C 1970 865
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