Cas no 35179-52-3 (1H-Imidazole,2-methyl-1-(1-methylethyl)-4-nitro-)
35179-52-3 structure
Product Name:1H-Imidazole,2-methyl-1-(1-methylethyl)-4-nitro-
CAS No:35179-52-3
MF:C7H11N3O2
MW:169.181141138077
CID:303577
PubChem ID:2775077
Update Time:2025-04-19
1H-Imidazole,2-methyl-1-(1-methylethyl)-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole,2-methyl-1-(1-methylethyl)-4-nitro-
- 1-ISOPROPYL-2-METHYL-4-NITRO-1H-IMIDAZOLE
- 2-methyl-1-(1-methylethyl)-4-nitro-1H-Imidazole
- 2-methyl-4-nitro-1-propan-2-ylimidazole
- 1-Isopropyl-2-methyl-4-nitroimidazol
- 1-Isopropyl-2-methyl-4-nitroimidazole
- HMS547K19
- MLS000851085
- CHEMBL1888148
- SMR000457328
- SR-01000639430-1
- AM20090553
- DTXSID00379364
- AKOS015905939
- MFCD00173737
- CCG-50021
- 1-isopropyl-2-methyl-4-nitro-imidazole
- FT-0607980
- 35179-52-3
- Maybridge1_002175
- HMS2803B22
- A822627
-
- Inchi： 1S/C7H11N3O2/c1-5(2)9-4-7(10(11)12)8-6(9)3/h4-5H,1-3H3
- InChI Key： VMJLLYLWZBSRIP-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CN(C(C)=N1)C(C)C)=O
Computed Properties
- Exact Mass: 169.08500
- Monoisotopic Mass: 169.085
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 178
- 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: 0.5
- Topological Polar Surface Area: 63.6?2
Experimental Properties
- Density: 1.25
- Boiling Point: 309.3°Cat760mmHg
- Flash Point: 140.9°C
- Refractive Index: 1.571
- PSA: 63.64000
- LogP: 2.20380
1H-Imidazole,2-methyl-1-(1-methylethyl)-4-nitro- Related Literature
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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3. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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