Cas no 38171-54-9 (sodium 3-aminophenolate)
sodium 3-aminophenolate structure
Product Name:sodium 3-aminophenolate
CAS No:38171-54-9
MF:C6H6NNaO
MW:131.107712268829
CID:1488277
PubChem ID:23669774
Update Time:2025-04-21
sodium 3-aminophenolate Chemical and Physical Properties
Names and Identifiers
-
- sodium 3-aminophenolate
- m-Aminofenolate sodny
- sodium m-aminophenoxide
- 38171-54-9
- SCHEMBL9178016
- VLDROEPDJWRSGR-UHFFFAOYSA-M
- 3-Aminophenol sodium
- Phenol, 3-amino-, sodium salt
- DTXSID50191558
- sodium meta-aminophenolate
- m-Aminofenolate sodny [Czech]
- sodium m-aminophenolate
- m-Aminophenol sodium
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- Inchi: 1S/C6H7NO.Na/c7-5-2-1-3-6(8)4-5;/h1-4,8H,7H2;/q;+1/p-1
- InChI Key: VLDROEPDJWRSGR-UHFFFAOYSA-M
- SMILES: [Na+].[O-]C1=CC=CC(=C1)N
Computed Properties
- Exact Mass: 131.03478
- Monoisotopic Mass: 131.03470810g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 79.5
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 49.1?2
Experimental Properties
- PSA: 49.08
sodium 3-aminophenolate Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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