Cas no 392741-20-7 (Benzoic acid,2,4-dihydroxy-, 2-acetylhydrazide)
392741-20-7 structure
Product Name:Benzoic acid,2,4-dihydroxy-, 2-acetylhydrazide
CAS No:392741-20-7
MF:C9H10N2O4
MW:210.186702251434
CID:299459
Update Time:2024-01-27
Benzoic acid,2,4-dihydroxy-, 2-acetylhydrazide Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid,2,4-dihydroxy-, 2-acetylhydrazide
- Benzoic acid, 2,4-dihydroxy-, 2-acetylhydrazide (9CI)
- Benzoic acid, 2,4-dihydroxy-, 2-acetylhydrazide
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- Inchi： 1S/C9H10N2O4/c1-5(12)10-11-9(15)7-3-2-6(13)4-8(7)14/h2-4,13-14H,1H3,(H,10,12)(H,11,15)
- InChI Key： MTNBUDDRDRMGQD-UHFFFAOYSA-N
- SMILES： C(NNC(C)=O)(=O)C1=CC=C(O)C=C1O
Computed Properties
- Exact Mass: 210.064
- Monoisotopic Mass: 210.064
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 257
- 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: 0.9
Experimental Properties
- Density: 1.409±0.06 g/cm3(Predicted)
- Boiling Point: 560.5±33.0 °C(Predicted)
- pka: 7.83±0.35(Predicted)
Benzoic acid,2,4-dihydroxy-, 2-acetylhydrazide Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
392741-20-7 (Benzoic acid,2,4-dihydroxy-, 2-acetylhydrazide) Related Products
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