2-NITROPROPANE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C3H7NO2
Molecular Weight	89.0932
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=FGLBSLMDCBOPQK-UHFFFAOYSA-N

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

HIDE SMILES / InChI

Molecular Formula	C3H7NO2
Molecular Weight	89.0932
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Purification, characterization, and mechanism of a flavin mononucleotide-dependent 2-nitropropane dioxygenase from Neurospora crassa.	1998 Mar	9501443
Protective effect of diphenyl diselenide on acute liver damage induced by 2-nitropropane in rats.	2005 May 15	15804453
Probing the "additive effect" in the proline and proline hydroxamic acid catalyzed asymmetric addition of nitroalkanes to cyclic enones.	2005 Nov	16189834
Differences in gene expression profiles in the liver between carcinogenic and non-carcinogenic isomers of compounds given to rats in a 28-day repeat-dose toxicity study.	2006 Dec 15	17070881
Optimization of the catalytic asymmetric addition of nitroalkanes to cyclic enones with trans-4,5-methano-L-proline.	2006 Oct 12	17020303
Carbanion reactivity, kinetic and equilibrium studies of sigma-adduct formation and elimination in the reactions of 4-nitrobenzofurazan derivatives with nitroalkane anions.	2007 May 21	17571196
Cytochrome P450 reductase: a harbinger of diffusible reduced oxygen species.	2010 Oct 13	20967245
New short term prediction method for chemical carcinogenicity by hepatic transcript profiling following 28-day toxicity tests in rats.	2011	22084566

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:41:32 GMT 2023` Edited by `admin` on `Fri Dec 15 16:41:32 GMT 2023`
Record UNII	GKV234L2QH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-NITROPROPANE

Systematic Name

English

2-NITROPROPANE [IARC]

Common Name

English

DIMETHYLNITROMETHANE

Systematic Name

English

ISONITROPROPANE

Common Name

English

2-NITROPROPANE [HSDB]

Common Name

English

PROPANE, 2-NITRO

Common Name

English

NITROPROPANE, 2-

Systematic Name

English

1-METHYLNITROETHANE

Systematic Name

English

2-NITROPROPANE [MI]

Common Name

English

NSC-5369

Code

English

Classification Tree Code System Code

EPA PESTICIDE CODE

600029