Cas no 29368-88-5 (Benzenecarboximidamide, 2-amino-N-(benzoyloxy)-)
29368-88-5 structure
Product Name:Benzenecarboximidamide, 2-amino-N-(benzoyloxy)-
CAS No:29368-88-5
MF:C14H13N3O2
MW:255.271922826767
CID:1438621
PubChem ID:71357492
Update Time:2025-04-20
Benzenecarboximidamide, 2-amino-N-(benzoyloxy)- Chemical and Physical Properties
Names and Identifiers
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- Benzenecarboximidamide, 2-amino-N-(benzoyloxy)-
- [[amino-(2-aminophenyl)methylidene]amino] benzoate
- 2-Amino-N'-(benzoyloxy)benzene-1-carboximidamide
- DTXSID80781562
- 29368-88-5
-
- Inchi： 1S/C14H13N3O2/c15-12-9-5-4-8-11(12)13(16)17-19-14(18)10-6-2-1-3-7-10/h1-9H,15H2,(H2,16,17)
- InChI Key： GGXSDIQXYPSYEW-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC=CC=1)=O)N=C(C1C=CC=CC=1N)N
Computed Properties
- Exact Mass: 255.10089
- Monoisotopic Mass: 255.100776666g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 338
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 2.7
- Topological Polar Surface Area: 90.7?2
Experimental Properties
- PSA: 88.2
Benzenecarboximidamide, 2-amino-N-(benzoyloxy)- Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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