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Basic Information
CAS No.: 2042-14-0
Name: 4-Methyl-3-nitrophenol
Article Data: 31
Molecular Structure:
Molecular Structure of 2042-14-0 (4-Methyl-3-nitrophenol)
Formula: C7H7NO3
Molecular Weight: 153.137
Synonyms: p-Cresol,3-nitro- (7CI,8CI);3-Nitro-4-methylphenol;3-Nitro-p-cresol;4-Hydroxy-2-nitrotoluene;NSC41205;
EINECS: 218-044-6
Density: 1.32 g/cm3
Melting Point: 78-81 °C
Boiling Point: 276 °C at 760 mmHg
Flash Point: 125.2 °C
Solubility: Slightly soluble in water.
Appearance: Pale yellow crystalline sSolid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 37/39-26-36
Transport Information: UN 2446
PSA: 66.05000
LogP: 2.13200
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Chemistry

Product Name: 4-Methyl-3-nitrophenol (CAS NO.2042-14-0)

Molecular Formula: C7H7NO3
Molecular Weight: 153.14g/mol
Mol File: 2042-14-0.mol
EINECS: 218-044-6
Appearance: Pale Yellow Crystalline Solid
Melting Point: 78-81 °C 
Storage Temperature: 276 °C at 760 mmHg
Flash Point: 125.2 °C
Density: 1.32 g/cm3
Index of Refraction: 1.596 
Molar Refractivity: 39.5 cm3 
Molar Volume: 115.9 cm
Surface Tension: 54.7 dyne/cm
Enthalpy of Vaporization: 53.51 kJ/mol
Vapour Pressure: 0.00294 mmHg at 25°C
XLogP3-AA: 2.1
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of 4-Methyl-3-nitrophenol (CAS NO.2042-14-0):
  IUPAC Name: 4-methyl-3-nitrophenol
  Canonical SMILES: CC1=C(C=C(C=C1)O)[N+](=O)[O-]
  InChI: InChI=1S/C7H7NO3/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4,9H,1H3 
  InChIKey: BQEXDUKMTVYBRK-UHFFFAOYSA-N
Product Categories: Intermediates of Dyes and Pigments; Aromatic Phenols; Phenoles and thiophenoles; Aromatics Compounds; Naphthyridine,Quinoline; Aromatics

Uses

 4-Methyl-3-nitrophenol (CAS NO.2042-14-0)  is used as a organic reagent and pharmaceutical intermediates.

Safety Profile

Safety Information of 4-Methyl-3-nitrophenol (CAS NO.2042-14-0):
Hazard Codes:Xi  
Risk Statements:36/37/38
36/37/38:Irritating to eyes, respiratory system and skin 
Safety Statements:37/39-26-36
37/39:Wear suitable gloves and eye/face protection 
26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36:Wear suitable protective clothing  
RIDADR:2446
Hazard Note:Irritant
HazardClass:6.1
PackingGroup:III

Specification

 4-Methyl-3-nitrophenol , its CAS NO. is 2042-14-0, the synonyms are 3-Nitro-p-cresol ; p-Cresol, 3-nitro- ; 2-Nitro-4-hydroxytoluene ; 3-Nitro-4-methylphenol .