Cas no 17625-82-0 (6-bromobenzene-1,2,4-triamine)
6-bromobenzene-1,2,4-triamine structure
Product Name:6-bromobenzene-1,2,4-triamine
CAS No:17625-82-0
MF:C6H8BrN3
MW:202.051819801331
CID:1368786
PubChem ID:176941
Update Time:2025-04-20
6-bromobenzene-1,2,4-triamine Chemical and Physical Properties
Names and Identifiers
-
- 6-bromobenzene-1,2,4-triamine
- 17625-82-0
- Benzene-1,2,4-triamine, 6-bromo-
- DTXSID70170103
- (2,5-Diamino-3-bromophenyl)amine
- SCHEMBL11537346
-
- Inchi： 1S/C6H8BrN3/c7-4-1-3(8)2-5(9)6(4)10/h1-2H,8-10H2
- InChI Key： ZHJDHKSKSXCPFL-UHFFFAOYSA-N
- SMILES： BrC1=CC(=CC(=C1N)N)N
Computed Properties
- Exact Mass: 200.99024
- Monoisotopic Mass: 200.99
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 120
- 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: 0.6
- Topological Polar Surface Area: 78.1?2
Experimental Properties
- Density: 1.796
- Boiling Point: 367.6°C at 760 mmHg
- Flash Point: 176.1°C
- Refractive Index: 1.768
- PSA: 78.06
6-bromobenzene-1,2,4-triamine Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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