Cas no 118-95-6 (Phenol,2-(1-methylethyl)-4,6-dinitro-)
118-95-6 structure
Product Name:Phenol,2-(1-methylethyl)-4,6-dinitro-
Phenol,2-(1-methylethyl)-4,6-dinitro- Chemical and Physical Properties
Names and Identifiers
-
- Phenol,2-(1-methylethyl)-4,6-dinitro-
- 2,4-dinitro-6-propan-2-ylphenol
- 2,4-Dinitro-6-isopropylphenol
- 2,4-Dinitro-6-isopropyl-phenol
- 2.4-Dinitro-6-isopropyl-phenol
- 2-isopropyl-4,6-dinitro-phenol
- 2-Isopropyl-4,6-dinitrophenol
- 4,6-Dinitro-2-isopropylphenol
- 4,6-Dinitro-2-isopropyl-phenol
- 4,6-dinitro-o-isopropylphenol
- Dinitro-iso-propylphenol
- Motylkopielik
- Phenol, (1-methylethyl)dinitro-
- Phenol, 2,4-dinitro-6-isopropyl-
- 4-06-00-03213 (Beilstein Handbook Reference)
- 118-95-6
- NSC5735
- DTXSID6074463
- Isopropyl-4,6-dinitrophenol
- Phenol, 2-isopropyl-4,6-dinitro-
- SCHEMBL5082940
- NSC-5735
- Phenol, 2-(1-methylethyl)-4,6-dinitro-
- BRN 2136067
- HBYHYLBZPLCIEE-UHFFFAOYSA-N
- NSC 5735
- 29385-11-3
- 2-Isopropyl-4,6-dinitrophenol #
- AKOS024333876
- DNPP
- EINECS 249-592-4
-
- Inchi： 1S/C9H10N2O5/c1-5(2)7-3-6(10(13)14)4-8(9(7)12)11(15)16/h3-5,12H,1-2H3
- InChI Key： HBYHYLBZPLCIEE-UHFFFAOYSA-N
- SMILES： OC1C(=CC(=CC=1C(C)C)[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 226.059
- Monoisotopic Mass: 226.05897142g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 283
- 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
- Surface Charge: 0
- Tautomer Count: 4
- XLogP3: nothing
- Topological Polar Surface Area: 112?2
Experimental Properties
- PSA: 106.51
- LogP: 3.37840
Phenol,2-(1-methylethyl)-4,6-dinitro- Related Literature
-
Lydie Viau,Michael Knorr,Lena Knauer,Lukas Brieger,Carsten Strohmann Dalton Trans. 2022 51 7581
-
Yilin Sun,Guangming Wu,Dinghai Cen,Yaofeng Chen,Limin Wang Dalton Trans. 2012 41 9682
-
Malcolm R. Smyth,W. Franklin Smyth Analyst 1978 103 529
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