(4-nitrophenyl)hydrazine

• ChemBase ID: 79298
• Molecular Formular: C6H7N3O2
• Molecular Mass: 153.13868
• Monoisotopic Mass: 153.05382648
• SMILES: [N+](=O)(c1ccc(cc1)NN)[O-]
• Canonical SMILES: NNc1ccc(cc1)[N+](=O)[O-]
• InChI: InChI=1S/C6H7N3O2/c7-8-5-1-3-6(4-2-5)9(10)11/h1-4,8H,7H2
• InChIKey: KMVPXBDOWDXXEN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4-nitrophenyl)hydrazine
• IUPAC Traditional name: hydrazine, (4-nitrophenyl)-
• Synonyms: 4-Nitrophenylhydrazine; 4-Nitrophenylhydrazine; p-NITROPHENYLHYDRAZINE HYDROCHLORIDE; p-Hydrazinonitrobenzene; 4-Nitrophenylhydrazine; p-NITROPHENYLHYDRAZINE; 4-硝基苯肼

Database IDs

• CAS Number: 100-16-3
• EC Number: 202-824-8
• MDL Number: MFCD00007579
• Beilstein Number: 608107
• PubChem SID: 162044061; 24883239
• PubChem CID: 3310889

CALCULATED PROPERTIES

• Acid pKa: 18.42573
• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 1.1623845
• LogD (pH = 7.4): 1.3027383
• Log P: 1.3048726
• Molar Refractivity: 43.0894 cm^3
• Polarizability: 14.791496 Å^3
• Polar Surface Area: 83.87 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 156 °C (dec.)(lit.); 156°C (dec.); 156-158(dec.)°C

Safety Information

• Storage Condition: 2-8°C
• Storage Warning: Highly Flammable/Harmful
• RTECS: MV8225000
• European Hazard Symbols: Flammable (F); Harmful (Xn)
• UN Number: 1325; 3376
• German water hazard class: 3
• Hazard Class: 4.1
• Packing Group: 1; III
• Australian Hazchem: 1Z
• Risk Statements: 5-11-21/22; R:30
• Safety Statements: 16-26-36; S:16
• EU Classification: F1
• EU Hazard Identification Number: 4.1B
• Emergency Response Guidebook(ERG) Number: 133
• GHS Pictograms: GHS02; GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H228-H302-H312-H315-H317-H319-H335
• GHS Precautionary statements: P210-P261-P280-P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
• RID/ADR: UN 3376 4.1/PG 1

Product Information

• Purity: 96%; 98%
• Contains: ≥10% water as stabilizer; ≥30% water as stabilizer
• Linear Formula: O2NC6H4NHNH2

DETAILS

MP Biomedicals - 05216398

MP Biomedicals Rare Chemical collection

MP Biomedicals - 02151764

Crystalline
Purity: 98%
Reagent for colorimetric determination of aldehydes and ketones.

Apollo Scientific Ltd - OR21751

Stabilised with >30% water

Sigma Aldrich - 642983

Packaging
5, 25 g in glass bottle