Cas no 133070-80-1 (Benzene, 2-ethoxy-1,4-dinitro- (9CI))
133070-80-1 structure
Product Name:Benzene, 2-ethoxy-1,4-dinitro- (9CI)
CAS No:133070-80-1
MF:C8H8N2O5
MW:212.15952205658
CID:1022766
PubChem ID:11492199
Update Time:2025-04-20
Benzene, 2-ethoxy-1,4-dinitro- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2-ethoxy-1,4-dinitro- (9CI)
- 2-ethoxy-1,4-dinitrobenzene
- 133070-80-1
- DTXSID20467499
- BENZENE, 2-ETHOXY-1,4-DINITRO-
- SCHEMBL11058768
- DB-285318
-
- Inchi： 1S/C8H8N2O5/c1-2-15-8-5-6(9(11)12)3-4-7(8)10(13)14/h3-5H,2H2,1H3
- InChI Key： HYQXQXJWUMOPKU-UHFFFAOYSA-N
- SMILES： O(CC)C1C=C(C=CC=1[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 212.04334
- Monoisotopic Mass: 212.04332136g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 246
- 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: 101?2
Experimental Properties
- PSA: 95.51
Benzene, 2-ethoxy-1,4-dinitro- (9CI) Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
133070-80-1 (Benzene, 2-ethoxy-1,4-dinitro- (9CI)) Related Products
- 6313-37-7(2,5-Dimethoxy-4-nitroaniline)
- 13350-09-9(1-Nitro-2-(prop-2-yn-1-yloxy)benzene)
- 119-23-3(2,5-Diethoxynitrobenzene)
- 3962-77-4(2,5-Dinitroanisole)
- 135-15-9(1,4-Dibutoxy-2-nitrobenzene)
- 105168-92-1(4-Nitro-2-propoxyaniline)
- 122329-02-6(1-Nitro-2-(tetradecyloxy)benzene)
- 37682-29-4(2-Nitrophenyl octyl ether)
- 15174-02-4(4-Methoxy-3-nitrophenol)
- 16365-25-6(2-(2-nitrophenoxy)ethan-1-ol)
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