(3-methylphenyl)hydrazine hydrochloride

• ChemBase ID: 69918
• Molecular Formular: C7H11ClN2
• Molecular Mass: 158.62864
• Monoisotopic Mass: 158.06107604
• SMILES: N(N)c1cc(ccc1)C.Cl
• Canonical SMILES: NNc1cccc(c1)C.Cl
• InChI: InChI=1S/C7H10N2.ClH/c1-6-3-2-4-7(5-6)9-8;/h2-5,9H,8H2,1H3;1H
• InChIKey: SHTBTGXNVWYODU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3-methylphenyl)hydrazine hydrochloride
• IUPAC Traditional name: (3-methylphenyl)hydrazine hydrochloride
• Synonyms: 3-Methylphenylhydrazine HCl; 3-Methylphenylhydrazine hydrochloride; m-Tolylhydrazine hydrochloride; m-tolylhydrazine hydrochloride; 3-Methylphenylhydrazine hydrochloride; 3-甲基苯肼 盐酸盐; 间甲基苯肼 盐酸盐; 间甲苯肼盐酸盐

Database IDs

• CAS Number: 637-04-7
• EC Number: 211-276-9
• MDL Number: MFCD00012932
• Beilstein Number: 3563995
• PubChem SID: 162035643; 24900190; 24889302
• PubChem CID: 71562

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.6303076
• LogD (pH = 7.4): 1.8741173
• Log P: 1.8783098
• Molar Refractivity: 40.8059 cm^3
• Polarizability: 14.672173 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 184-194 °C (dec.)(lit.); 193°C; ca 193°C dec.

Safety Information

• Storage Warning: Harmful/Irritant; IRRITANT
• European Hazard Symbols: X; Harmful (Xn)
• UN Number: UN2811
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 20/21/22-36/37/38; 22-36/37/38
• Safety Statements: 26-36/37; 26-36/37/39
• TSCA Listed: false; 否
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H312-H315-H319-H332-H335; H302-H315-H319-H335
• GHS Precautionary statements: P261-P280-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥98.0% (AT); 95+%; 97%; 98%; 99%
• Grade: purum
• Salt Data: HCl
• Ignition Residue: ≤0.5%
• Linear Formula: CH3C6H4NHNH2 · HCl

DETAILS

Sigma Aldrich - T40401

Packaging
10 g in glass bottle