2,6-dimethylpyridin-3-amine

• ChemBase ID: 70805
• Molecular Formular: C7H10N2
• Molecular Mass: 122.1677
• Monoisotopic Mass: 122.08439833
• SMILES: c1(c(ccc(n1)C)N)C
• Canonical SMILES: Cc1ccc(c(n1)C)N
• InChI: InChI=1S/C7H10N2/c1-5-3-4-7(8)6(2)9-5/h3-4H,8H2,1-2H3
• InChIKey: WISXXOGOMDYNSN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,6-dimethylpyridin-3-amine
• IUPAC Traditional name: 2,6-dimethylpyridin-3-amine
• Synonyms: 2,6-Dimethylpyridin-3-amine; 3-Amino-2,6-dimethylpyridine; 3-Amino-2,6-dimethylpyridine; 2,6-Dimethylpyridin-3-amine; 3-Amino-2,6-lutidine; 3-氨基-2,6-二甲基吡啶

Database IDs

• CAS Number: 3430-33-9
• EC Number: 222-332-7
• MDL Number: MFCD01646409
• Beilstein Number: 2424
• PubChem SID: 162036515
• PubChem CID: 76964

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -1.1691219
• LogD (pH = 7.4): 0.05156596
• Log P: 0.18938777
• Molar Refractivity: 37.7845 cm^3
• Polarizability: 14.100557 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 121 - 123°C; 121-123°C; 121-123°C
• Boiling Point: 230°C; 230°C
• Hydrophobicity(logP): 1.266

Safety Information

• Storage Warning: IRRITANT; Toxic/Harmful/Irritant/Store under Argon
• European Hazard Symbols: X
• UN Number: UN2811
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 20/21/22-36/37/38
• Safety Statements: 9-26-36/37
• TSCA Listed: false; 否
• GHS Pictograms: GHS06
• GHS Hazard statements: H331-H302-H312-H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A

Product Information

• Purity: 95%; 95+%; 97%