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625-48-9 | 2-Nitroethanol
CAS No: 625-48-9 Catalog No: AG0033EX MDL No:MFCD00007405
Product Description
Catalog Number:
AG0033EX
Chemical Name:
2-Nitroethanol
CAS Number:
625-48-9
Molecular Formula:
C2H5NO3
Molecular Weight:
91.0660
MDL Number:
MFCD00007405
IUPAC Name:
2-nitroethanol
InChI:
InChI=1S/C2H5NO3/c4-2-1-3(5)6/h4H,1-2H2
InChI Key:
KIPMDPDAFINLIV-UHFFFAOYSA-N
SMILES:
OCCN(=O)=O
EC Number:
210-895-1
NSC Number:
16151
Properties
Complexity:
47.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
91.027g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
91.066g/mol
Monoisotopic Mass:
91.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
Literature
| Title | Journal |
|---|---|
| Combination effects of nitrocompounds, pyromellitic diimide, and 2-bromoethanesulfonate on in vitro ruminal methane production and fermentation of a grain-rich feed. | Journal of agricultural and food chemistry 20120111 |
| Determination of ethylene glycol dinitrate in dynamites using HPLC: application to the plastic explosive Goma-2 ECO. | Journal of separation science 20111201 |
| Study of losses of volatile compounds from dynamites. Investigation of cross-contamination between dynamites stored in polyethylene bags. | Forensic science international 20110910 |
| Simultaneous Raman spectroscopy-laser-induced breakdown spectroscopy for instant standoff analysis of explosives using a mobile integrated sensor platform. | Analytical chemistry 20100215 |
| Diphenylprolinol silyl ether as a catalyst in an asymmetric, catalytic, and direct michael reaction of nitroethanol with alpha,beta-unsaturated aldehydes. | Organic letters 20090917 |
| Effect of nitroethane and nitroethanol on the production of indole and 3-methylindole (skatole) from bacteria in swine feces by gas chromatography. | Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes 20090801 |
| Different sets of reliability data and success criteria in a probabilistic safety assessment for a plant producing nitroglycol. | Journal of hazardous materials 20090315 |
| Initial studies using aliphatic beta-nitro alcohols for therapeutic corneal cross-linking. | Investigative ophthalmology & visual science 20090301 |
| Effects of select nitrocompounds on in vitro ruminal fermentation during conditions of limiting or excess added reductant. | Bioresource technology 20081201 |
| Aliphatic beta-nitro alcohols for non-enzymatic collagen cross-linking of scleral tissue. | Experimental eye research 20080901 |
| Synthesis, structure, and E-Z isomerization of beta-(hetero)aryl-alpha-nitro-alpha,beta-enals. | The Journal of organic chemistry 20080516 |
| Effects of short-chain nitrocompounds against Campylobacter jejuni and Campylobacter coli in vitro. | Journal of food science 20070301 |
| Effects of nitrate or nitro supplementation, with or without added chlorate, on Salmonella enterica serovar Typhimurium and Escherichia coli in swine feces. | Journal of food protection 20070201 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| Inhibitory effect of select nitrocompounds on growth and survivability of Listeria monocytogenes in vitro. | Journal of food protection 20060501 |
| Effects of nitro compounds and feedstuffs on in vitro methane production in chicken cecal contents and rumen fluid. | Anaerobe 20060401 |
| Growth inhibition by nitrocompounds of selected uric acid-utilizing microorganisms isolated from poultry manure. | Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes 20060101 |
| Quantitative evaluation of the catalytic activity of dendrimers with only one active center at the core: application to the nitroaldol (Henry) reaction. | Journal of the American Chemical Society 20040428 |
| Effect of select nitrocompounds on ruminal fermentation; an initial look at their potential to reduce economic and environmental costs associated with ruminal methanogenesis. | Bioresource technology 20031001 |
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