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Home > Nitro Compounds > 25182-84-7
25182-84-7 | 1-Propanol, 3-nitro-
CAS No: 25182-84-7 Catalog No: AG002QSE MDL No:MFCD00040626
Product Description
Catalog Number:
AG002QSE
Chemical Name:
1-Propanol, 3-nitro-
CAS Number:
25182-84-7
Molecular Formula:
C3H7NO3
Molecular Weight:
105.0926
MDL Number:
MFCD00040626
IUPAC Name:
3-nitropropan-1-ol
InChI:
InChI=1S/C3H7NO3/c5-3-1-2-4(6)7/h5H,1-3H2
InChI Key:
YISPKQZWSIMXMX-UHFFFAOYSA-N
SMILES:
OCCC[N+](=O)[O-]
EC Number:
246-716-9
UNII:
9284XW200I
Properties
Complexity:
57.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
105.043g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
105.093g/mol
Monoisotopic Mass:
105.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
Literature
| Title | Journal |
|---|---|
| A Sensitive and Simple HPLC-UV Method for Trace Level Quantification of Ethyl p-Toluenesulfonate and Methyl p-Toluenesulfonate, Two Potential Genotoxins in Active Pharmaceutical Ingredients. | Scientia pharmaceutica 20110101 |
| Effects of nitrocompounds on uric acid-utilizing microorganisms, nitrogen retention, and microbial community in laying hen manure. | Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes 20090501 |
| Sequence variation in human succinate dehydrogenase genes: evidence for long-term balancing selection on SDHA. | BMC biology 20070101 |
| 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 |
| Toxicity and metabolism of the conjugates of 3-nitropropanol and 3-nitropropionic acid in forages poisonous to livestock. | Journal of agricultural and food chemistry 20050323 |
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