Cas no 2086-01-3 (N,N'-dihydroxybenzenecarboximidamide)
2086-01-3 structure
Product Name:N,N'-dihydroxybenzenecarboximidamide
CAS No:2086-01-3
MF:C7H8N2O2
MW:152.150621414185
CID:910671
PubChem ID:270771
Update Time:2025-04-19
N,N'-dihydroxybenzenecarboximidamide Chemical and Physical Properties
Names and Identifiers
-
- N,N'-dihydroxybenzenecarboximidamide
- CTK0E2873; Benzamide, N-chloro-; N,N'-dihydroxybenzamidine; N-chloro-benzamide; benzhydroxamic acid chloride; Benzoesaeure-oxyamidoxim; Benzoxyamidoxim; Benzenyloxyamidoxim; Benzohydroximsaeure-hydroxyamid; 2-CHLORO BENZAMIDE; N-Chlor-benzamid; benzohydroxamic chloride; AG-E-31983; benzohydroximic acid hydroxyamide; N.N'-Dioxy-benzamidin;
- bis-N-hydroxybenzamidine
- DTXSID10943116
- SCHEMBL134570
- 2086-01-3
-
- Inchi： 1S/C7H8N2O2/c10-8-7(9-11)6-4-2-1-3-5-6/h1-5,10-11H,(H,8,9)
- InChI Key： XMGVAJROQWDXLX-UHFFFAOYSA-N
- SMILES： ONC(C1C=CC=CC=1)=NO
Computed Properties
- Exact Mass: 152.05864
- Monoisotopic Mass: 152.058578
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 141
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 64.8
- XLogP3: 1.5
Experimental Properties
- Density: 1.26
- Boiling Point: 343.9°C at 760 mmHg
- Flash Point: 161.8°C
- Refractive Index: 1.578
- PSA: 64.85
N,N'-dihydroxybenzenecarboximidamide Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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