Cas no 17697-36-8 (Propane, 1-methoxy-2-methyl-2-nitro-)
17697-36-8 structure
Product Name:Propane, 1-methoxy-2-methyl-2-nitro-
CAS No:17697-36-8
MF:C5H11NO3
MW:133.145741701126
CID:1363950
PubChem ID:71353426
Update Time:2025-04-20
Propane, 1-methoxy-2-methyl-2-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Propane, 1-methoxy-2-methyl-2-nitro-
- 1-methoxy-2-methyl-2-nitropropane
- 17697-36-8
- DTXSID00778171
-
- Inchi： 1S/C5H11NO3/c1-5(2,4-9-3)6(7)8/h4H2,1-3H3
- InChI Key： PMCQVNJEQPDZGB-UHFFFAOYSA-N
- SMILES： O(C)CC(C)(C)[N+](=O)[O-]
Computed Properties
- Exact Mass: 133.07389321g/mol
- Monoisotopic Mass: 133.07389321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 105
- 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: 55?2
Propane, 1-methoxy-2-methyl-2-nitro- Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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