Cas no 34277-78-6 ( )
structure
Product Name:
CAS No:34277-78-6
MF:C9H9N3O2S
MW:223.251660108566
CID:918943
PubChem ID:2735472
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- N-(carbamoylcarbamothioyl)benzamide
- 1-benzoyl-2-monothiobiuret
- 1-Benzoyl-2-Phenylsulfonylhydrazin
- 1-benzoyl-2-phenylsulfonylhydrazine
- AC1L6BFD
- AC1Q6WA5
- Benzoesaeure-(N'-benzolsulfonyl-hydrazid)
- benzoic acid, 2-(phenylsulfonyl)hydrazide
- Benzolsulfonsaeure-N'-benzoyl-hydrazid
- N'-(phenylsulfonyl)benzohydrazide
- N-benzenesulfonyl-N'-benzoylhydrazine
- N-benzenesulfonyl-N'-benzoyl-hydrazine
- N-Benzolsulfonyl-N'-benzoyl-hydrazin
- PhSO2N2 PhCO de
- SureCN4765513
- 41835-24-9
- 34277-78-6
- AKOS015839023
- NSC142465
- N-[(carbamoylamino)methanethioyl]benzamide
- CHEMBL220433
- SCHEMBL8161522
- DS-000391
- A825668
- N-[{[Hydroxy(imino)methyl]imino}(sulfanyl)methyl]benzenecarboximidic acid
- 1-(benzoylcarbamothioyl)urea
- 1-Benzoyl-2-thiobiuret
- DTXSID50955834
- N-(carbamoylthiocarbamoyl)benzamide
- 1-benzoylthiobiuret
- NSC-142465
- MFCD00025451
-
-
- MDL： MFCD00025451
- Inchi： 1S/C9H9N3O2S/c10-8(14)12-9(15)11-7(13)6-4-2-1-3-5-6/h1-5H,(H4,10,11,12,13,14,15)
- InChI Key： XZWNNLCHQSTQJP-UHFFFAOYSA-N
- SMILES： S=C(NC(N)=O)NC(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 223.04167
- Monoisotopic Mass: 223.04154771g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 275
- 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: 1.9
- Topological Polar Surface Area: 116?2
Experimental Properties
- PSA: 84.22
- LogP: 1.85170
Related Literature
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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