Cas no 53338-46-8 ( )
structure
Product Name:
CAS No:53338-46-8
MF:C4H4Br2N4
MW:267.909358024597
CID:938343
PubChem ID:296118
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 5,6-dibromopyrazine-2,3-diamine
- 2,3-Diamino-5,6-dibrompyrazin
- 5,6-dibromo-pyrazine-2,3-diamine
- AC1L6PO4
- diamino-dibromopyrazine
- NSC165920
- 53338-46-8
- DTXSID00304494
- NSC-165920
- SCHEMBL11834767
-
-
- Inchi： 1S/C4H4Br2N4/c5-1-2(6)10-4(8)3(7)9-1/h(H2,7,9)(H2,8,10)
- InChI Key： SEIVMNILYAKPCI-UHFFFAOYSA-N
- SMILES： BrC1=C(N=C(C(N)=N1)N)Br
Computed Properties
- Exact Mass: 265.88032
- Monoisotopic Mass: 265.88027g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 108
- 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: 1.1
- Topological Polar Surface Area: 77.8?2
Experimental Properties
- PSA: 77.82
- LogP: 2.32840
Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
-
Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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