Cas no 61787-75-5 (Benzenecarboximidoyl-(trimethylazaniumyl)azanide)
61787-75-5 structure
Product Name:Benzenecarboximidoyl-(trimethylazaniumyl)azanide
CAS No:61787-75-5
MF:C10H15N3
MW:177.246201753616
CID:955122
PubChem ID:12362610
Update Time:2025-04-19
Benzenecarboximidoyl-(trimethylazaniumyl)azanide Chemical and Physical Properties
Names and Identifiers
-
- Benzenecarboximidoyl-(trimethylazaniumyl)azanide
- 61787-75-5
- NSC-294938
- NSC294938
- DTXSID30494251
- 1-[Imino(phenyl)methyl]-2,2,2-trimethylhydrazin-2-ium-1-ide
-
- Inchi： 1S/C10H15N3/c1-13(2,3)12-10(11)9-7-5-4-6-8-9/h4-8,11H,1-3H3
- InChI Key： AKXTYULXSPQBNZ-UHFFFAOYSA-N
- SMILES： [N+](C)(C)(C)[N-]C(C1C=CC=CC=1)=N
Computed Properties
- Exact Mass: 178.13458
- Monoisotopic Mass: 177.126597491g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 175
- 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: 1.5
- Topological Polar Surface Area: 24.8?2
Experimental Properties
- PSA: 38.38
Benzenecarboximidoyl-(trimethylazaniumyl)azanide Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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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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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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