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Home Nitros 1-Propanol, 3-nitro-

1-Propanol, 3-nitro-

CAS No.:
25182-84-7
Catalog Number:
AG002QSE
Molecular Formula:
C3H7NO3
Molecular Weight:
105.0926
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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
Properties