Cas no 25168-04-1 (Benzene, dimethylnitro-)
Benzene, dimethylnitro- structure
Product Name:Benzene, dimethylnitro-
Benzene, dimethylnitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, dimethylnitro-
- 1,2-Dimethyl-3-nitrobenzene
- ar-Nitroxylene
- Nitroxylene
- Nitroxylenes, (m-, o-, p-)
- Xylene, ar-nitro-
- NS00022826
- NCGC00254235-01
- Q27259283
- o-Xylene, 3-nitro-
- SCHEMBL16791684
- NCGC00091139-04
- InChI=1/C8H9NO2/c1-6-4-3-5-8(7(6)2)9(10)11/h3-5H,1-2H
- AM10671
- 2,3-Dimethylnitrobenzene
- Benzene, 1,2-dimethyl-3-nitro-
- J-503832
- Tox21_300334
- 3-nitro-o-xylol
- Benzene,2-dimethyl-3-nitro-
- NSC-5402
- 2-methyl-3-nitrotoluene
- HSDB 8023
- SCHEMBL700469
- 83-41-0
- CAS-83-41-0
- AKOS000119945
- EINECS 201-474-3
- PS-10608
- D89776
- AC-10901
- EN300-19522
- 3-Nitro-ortho-xylene
- mononitroxylene
- NCGC00091139-03
- 49GNX4CY5W
- 2,3-Dimethyl nitro benzene
- NSC5402
- Tox21_202000
- NSC 5402
- 25168-04-1
- CCRIS 3117
- NCGC00091139-01
- AI3-29558
- NCGC00091139-02
- CHEMBL1596825
- 2,6-Dimethyl-d6-nitrobenzene
- 3-nitro o-xylene
- FT-0616255
- MFCD00007162
- D1076
- Z104474110
- 1,2-Dimethyl-3-nitrobenzene, Selectophore(TM), >=99.0%
- DTXSID7025132
- 2,3-dimethyl-1-nitrobenzene
- 1,2-Dimethyl-3-nitrobenzene, 97%
- NCGC00259549-01
- Dimethyl-3-nitrobenzene, 1,2-
- UNII-49GNX4CY5W
- 2,3-DIMETHYLNITROBENZENE [HSDB]
- DTXCID405132
- 3-Nitro-o-xylene
-
- Inchi： 1S/C8H9NO2/c1-6-4-3-5-8(7(6)2)9(10)11/h3-5H,1-2H3
- InChI Key： FVHAWXWFPBPFOS-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC=CC(C)=C1C)=O
Computed Properties
- Exact Mass: 151.06337
- Monoisotopic Mass: 151.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 153
- 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: 2.8
- Topological Polar Surface Area: 45.8A^2
Experimental Properties
- Color/Form: 黃色 液體
- Density: 1.2023 (rough estimate)
- Melting Point: 2°C
- Boiling Point: 273.17°C (rough estimate)
- Flash Point: 225° F (NTP, 1992)
- Refractive Index: 1.5810 (estimate)
- PSA: 43.14
- LogP: log Kow = 2.83
Benzene, dimethylnitro- Security Information
- Storage Condition：Keep container tightly closed. Store in a cool, dry place away from incompatible substances.
Benzene, dimethylnitro- Related Literature
-
1. XXVII.—Nitro-derivatives of ortho-xyleneArthur William Crossley,Nora Renouf J. Chem. Soc. Trans. 1909 95 202
-
2. CCLVIII.—Derivatives of o-xylene. Part I. 3-Nitro-o-xylene and 3 : 6-dinitro-o-xyleneArthur William Crossley,Gertrude Holland Wren J. Chem. Soc. Trans. 1911 99 2341
-
3. Electrophilic aromatic substitution. Part 20. The solvolyses in aqueous sulphuric acid of 4-methyl-4-nitrocyclohexa-2,5-dienyl acetate and some of its homologues, and their relevance to the nitration of methylbenzenesHugh W. Gibbs,Roy B. Moodie,Kenneth Schofield J. Chem. Soc. Perkin Trans. 2 1978 1145
-
V. Askam,R. H. L. Deeks J. Chem. Soc. C 1969 1935
-
5. Relevance of the acidolysis of 3,4-dimethyl-4-nitrocyclohexa-2,5-dienyl acetate to the nitration of o-xyleneHugh W. Gibbs,Roy B. Moodie,Kenneth Schofield J. Chem. Soc. Chem. Commun. 1976 492
25168-04-1 (Benzene, dimethylnitro-) Related Products
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