2-nitropropane (CHEBI:16037)

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ChEBI Name	2-nitropropane

ChEBI ID	CHEBI:16037

Definition	A secondary nitroalkane that is propane in which a hydrogen at position 2 has been replaced by a nitro group. Mainly used as a solvent (b.p. 120°C).

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:44443, CHEBI:1226, CHEBI:11632, CHEBI:19727

Supplier Information	ChemicalBook:CB2727299, eMolecules:890573

Download	Molfile XML SDF

Wikipedia	License
Zinc sulfate is an inorganic compound with the formula ZnSO4. It forms hydrates ZnSO4·nH2O, where n can range from 0 to 7. All are colorless solids. The most common form includes water of crystallization as the heptahydrate, with the formula ZnSO4·7H2O. As early as the 16th century it was prepared on a large scale, and was historically known as "white vitriol" (the name was used, for example, in 1620s by the collective writing under the pseudonym of Basil Valentine). Zinc sulfate and its hydrates are colourless solids.
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Formula

C3H7NO2

Net Charge

Average Mass

89.09322

Monoisotopic Mass

89.04768

InChI

InChI=1S/C3H7NO2/c1-3(2)4(5)6/h3H,1-2H3

InChIKey

FGLBSLMDCBOPQK-UHFFFAOYSA-N

SMILES

CC(C)[N+]([O-])=O

Roles Classification
Chemical Role(s):	polar aprotic solvent A solvent with a comparatively high relative permittivity (or dielectric constant), greater than ca. 15, and a sizable permanent dipole moment, that cannot donate suitably labile hydrogen atoms to form strong hydrogen bonds.

Biological Role(s):	hepatotoxic agent A role played by a chemical compound exhibiting itself through the ability to induce damage to the liver in animals. carcinogenic agent A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities. xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.

Application(s):	polar aprotic solvent A solvent with a comparatively high relative permittivity (or dielectric constant), greater than ca. 15, and a sizable permanent dipole moment, that cannot donate suitably labile hydrogen atoms to form strong hydrogen bonds.

ChEBI Ontology
Outgoing	2-nitropropane (CHEBI:16037) has role carcinogenic agent (CHEBI:50903) 2-nitropropane (CHEBI:16037) has role hepatotoxic agent (CHEBI:50908) 2-nitropropane (CHEBI:16037) has role polar aprotic solvent (CHEBI:48358) 2-nitropropane (CHEBI:16037) has role xenobiotic (CHEBI:35703) 2-nitropropane (CHEBI:16037) is a secondary nitroalkane (CHEBI:139218)

IUPAC Name

2-nitropropane

Last Modified

13 December 2017