Cas no 88106-04-1 (Benzene, 2-bromo-1,3,4,5-tetranitro-)
88106-04-1 structure
Product Name:Benzene, 2-bromo-1,3,4,5-tetranitro-
CAS No:88106-04-1
MF:C6HBrN4O8
MW:336.998140096664
CID:644831
PubChem ID:13213783
Update Time:2025-04-19
Benzene, 2-bromo-1,3,4,5-tetranitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2-bromo-1,3,4,5-tetranitro-
- 2-bromo-1,3,4,5-tetranitrobenzene
- 88106-04-1
- DTXSID20528574
-
- Inchi: 1S/C6HBrN4O8/c7-4-2(8(12)13)1-3(9(14)15)5(10(16)17)6(4)11(18)19/h1H
- InChI Key: BNCKPCHTJSDNSV-UHFFFAOYSA-N
- SMILES: BrC1=C(C=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 335.89778g/mol
- Monoisotopic Mass: 335.89778g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 19
- Rotatable Bond Count: 0
- Complexity: 421
- 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: 1.9
- Topological Polar Surface Area: 183?2
Benzene, 2-bromo-1,3,4,5-tetranitro- Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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