Cas no 34604-42-7 (Benzoic acid, 4-[(dipropylamino)sulfonyl]-2-hydroxy-)
34604-42-7 structure
Product Name:Benzoic acid, 4-[(dipropylamino)sulfonyl]-2-hydroxy-
CAS No:34604-42-7
MF:C13H19NO5S
MW:301.358662843704
CID:1469292
PubChem ID:20071705
Update Time:2025-04-20
Benzoic acid, 4-[(dipropylamino)sulfonyl]-2-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 4-[(dipropylamino)sulfonyl]-2-hydroxy-
- 4-(dipropylsulfamoyl)-2-hydroxybenzoic acid
- SCHEMBL9796305
- DB-412021
- DTXSID10602130
- 34604-42-7
- 4-[(Dipropylamino)sulfonyl]-2-hydroxybenzoic acid
-
- Inchi: 1S/C13H19NO5S/c1-3-7-14(8-4-2)20(18,19)10-5-6-11(13(16)17)12(15)9-10/h5-6,9,15H,3-4,7-8H2,1-2H3,(H,16,17)
- InChI Key: FJRTZGPMJBKGCD-UHFFFAOYSA-N
- SMILES: S(C1C=CC(C(=O)O)=C(C=1)O)(N(CCC)CCC)(=O)=O
Computed Properties
- Exact Mass: 301.09847
- Monoisotopic Mass: 301.09839388g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 411
- 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: 2.9
- Topological Polar Surface Area: 103?2
Experimental Properties
- PSA: 94.91
Benzoic acid, 4-[(dipropylamino)sulfonyl]-2-hydroxy- Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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