1,1-diphenylhydrazine hydrochloride

• ChemBase ID: 103220
• Molecular Formular: C12H13ClN2
• Molecular Mass: 220.69802
• Monoisotopic Mass: 220.07672611
• SMILES: Cl.NN(c1ccccc1)c1ccccc1
• Canonical SMILES: NN(c1ccccc1)c1ccccc1.Cl
• InChI: InChI=1S/C12H12N2.ClH/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h1-10H,13H2;1H
• InChIKey: MIVUDWFNUOXEJM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,1-diphenylhydrazine hydrochloride
• IUPAC Traditional name: 1,1-diphenylhydrazine hydrochloride
• Synonyms: N,N-Diphenylhydrazine hydrochloride (asym.); N,N-Diphenylhydrazine hydrochloride; 1,1-diphenylhydrazine hydrochloride; N,N-Diphenylhydrazine hydrochloride; 1,1-DIPHENYLHYDRAZINE; N,N-Diphenylhydrazine (asym.) hydrochloride; 1,1-Diphenylhydrazine hydrochloride; N,N-二苯肼盐酸盐(不对称); N,N-二苯肼盐酸盐; 1,1-联苯基肼 盐酸盐; N,N-二苯肼（不对称） 盐酸盐; N,N-二苯基肼 盐酸盐

Database IDs

• CAS Number: 530-47-2
• EC Number: 208-481-0
• MDL Number: MFCD00012950
• Beilstein Number: 3569340
• Merck Index: 143325
• PubChem SID: 24847185; 24866944; 162091256
• PubChem CID: 10738

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 2.703729
• LogD (pH = 7.4): 2.8631644
• Log P: 2.8656
• Molar Refractivity: 69.3476 cm^3
• Polarizability: 22.537434 Å^3
• Polar Surface Area: 29.26 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 162-166 °C (dec.); ca 163°C dec.

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• RTECS: MV3520000
• European Hazard Symbols: Corrosive (C); X
• UN Number: 3261
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 20/21/22-34; 22-36/37/38
• Safety Statements: 26-36/37; 26-36/37/39-45
• TSCA Listed: 是
• GHS Pictograms: GHS05; GHS06; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H315-H319-H335; H302-H312-H314-H332
• GHS Precautionary statements: P261-P301+P310-P305+P351+P338-P302+P352-P405-P501A; P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 3261 8/PG 2

Product Information

• Purity: ≥97.0% (AT); 95+%; 97%; 98%
• Grade: technical
• Salt Data: HCl
• Linear Formula: (C6H5)2NNH2 · HCl

DETAILS

MP Biomedicals - 02150975

Hydrochloride

Sigma Aldrich - 114596

Other Notes
Small amounts of moisture cause melting point to vary greatly
Packaging
25 g in glass bottle

REFERENCES

• Water-soluble sugars can be isolated as their organic-soluble diphenylhydrazones. For an example, including regeneration of the sugar by exchange with formaldehyde, see: Org. Synth. Coll., 3, 101 (1955), Note 3.