4-Isopropyl-2,6-dinitrophenol supplier

Name
4-isopropyl-2,6-dinitrophenol
EINECS
CAS No. 4097-47-6
Article Data4
CAS DataBase
Density 1.399g/cm³
Solubility
Melting Point
Formula C9H10 N2 O5
Boiling Point 255.8°C at 760 mmHg
Molecular Weight 226.189
Flash Point 103.1°C
Transport Information
Appearance
Safety Poison by intraperitoneal route. When heated to decomposition it emits toxic fumes of NO_x. See also NITRO COMPOUNDS of AROMATIC HYDROCARBONS.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Phenol,4-isopropyl-2,6-dinitro- (7CI,8CI); 4-Isopropyl-2,6-dinitrophenol; NSC 21481
PSA 111.87000
LogP 3.37840

4-Isopropyl-2,6-dinitrophenol Chemical Properties

Product Name: 4-Isopropyl-2,6-dinitrophenol (CAS NO.4097-47-6)

Molecular Formula: C₉H₁₀N₂O₅
Molecular Weight: 226.1861g/mol
Mol File: 4097-47-6.mol
EINECS: 223-855-3
Boiling point: 255.8 °C at 760 mmHg
Flash Point: 103.1 °C
Density: 1.399 g/cm³
Surface Tension: 59.1 dyne/cm
Enthalpy of Vaporization: 51.32 kJ/mol
Vapour Pressure: 0.00996 mmHg at 25°C
XLogP3-AA: 2.9
H-Bond Donor: 1
H-Bond Acceptor: 5
Structure Descriptors of 4-Isopropyl-2,6-dinitrophenol (CAS NO.4097-47-6):
IUPAC Name: 2,6-Dinitro-4-propan-2-ylphenol
Canonical SMILES: CC(C)C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]
InChI: InChI=1S/C9H10N2O5/c1-5(2)6-3-7(10(13)14)9(12)8(4-6)11(15)16/h3-5,12H,1-2H3
InChIKey: FVMCLNZPDUOPJC-UHFFFAOYSA-N

4-Isopropyl-2,6-dinitrophenol Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LDLo	intraperitoneal	31300ug/kg (31.3mg/kg)	BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: DYSPNEA	"Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 6, Pg. 60, 1954.

4-Isopropyl-2,6-dinitrophenol Consensus Reports

Reported in EPA TSCA Inventory.

4-Isopropyl-2,6-dinitrophenol Safety Profile

Poison by intraperitoneal route. When heated to decomposition it emits toxic fumes of NO_x. See also NITRO COMPOUNDS of AROMATIC HYDROCARBONS.

4-Isopropyl-2,6-dinitrophenol Specification

4-Isopropyl-2,6-dinitrophenol , its CAS NO. is 4097-47-6, the synonyms are 2,6-Dinitro-4-isopropylphenol ; 4-06-00-03218 (Beilstein Handbook Reference) ; AI3-19043 ; BRN 2467409 ; EINECS 223-855-3 ; NSC 21481 ; Phenol, 2,6-dinitro-4-isopropyl- ; Phenol, 4-(1-methylethyl)-2,6-dinitro- .

Product Name

4-isopropyl-2,6-dinitrophenol

4-Isopropyl-2,6-dinitrophenol Chemical Properties

4-Isopropyl-2,6-dinitrophenol Toxicity Data With Reference

4-Isopropyl-2,6-dinitrophenol Consensus Reports

4-Isopropyl-2,6-dinitrophenol Safety Profile

4-Isopropyl-2,6-dinitrophenol Specification

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