Cas no 33250-29-2 (6,7-dihydro-5h-pyrazolo[1,2-a]pyrazol-4-ium-6-ol;bromide)
33250-29-2 structure
Product Name:6,7-dihydro-5h-pyrazolo[1,2-a]pyrazol-4-ium-6-ol;bromide
CAS No:33250-29-2
MF:C6H9BrN2O
MW:205.052460432053
CID:1456538
PubChem ID:24188884
Update Time:2025-04-20
6,7-dihydro-5h-pyrazolo[1,2-a]pyrazol-4-ium-6-ol;bromide Chemical and Physical Properties
Names and Identifiers
-
- NSC80269
- NSC-80269
- 6,7-dihydro-5H-pyrazolo[1,2-a]pyrazol-4-ium-6-ol,bromide
- 6,7-dihydro-5H-pyrazolo[1,2-a]pyrazol-4-ium-6-ol
- bromide
- 2-Hydroxy-2,3-dihydro-1H-pyrazolo[1,2-a]pyrazol-4-ium bromide
- 33250-29-2
- DTXSID00637517
- 6,7-dihydro-5h-pyrazolo[1,2-a]pyrazol-4-ium-6-ol;bromide
-
- Inchi: 1S/C6H9N2O.BrH/c9-6-4-7-2-1-3-8(7)5-6;/h1-3,6,9H,4-5H2;1H/q+1;/p-1
- InChI Key: VFQUFWPZISFCAA-UHFFFAOYSA-M
- SMILES: [Br-].OC1CN2C=CC=[N+]2C1
Computed Properties
- Exact Mass: 203.99000
- Monoisotopic Mass: 203.98983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 106
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 29?2
Experimental Properties
- PSA: 29.04000
- LogP: -3.84590
6,7-dihydro-5h-pyrazolo[1,2-a]pyrazol-4-ium-6-ol;bromide Related Literature
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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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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