4,6-dimethylpyridin-2-amine

• ChemBase ID: 68832
• Molecular Formular: C7H10N2
• Molecular Mass: 122.1677
• Monoisotopic Mass: 122.08439833
• SMILES: c1(cc(cc(n1)C)C)N
• Canonical SMILES: Cc1cc(C)nc(c1)N
• InChI: InChI=1S/C7H10N2/c1-5-3-6(2)9-7(8)4-5/h3-4H,1-2H3,(H2,8,9)
• InChIKey: BRBUBVKGJRPRRD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4,6-dimethylpyridin-2-amine
• IUPAC Traditional name: 2-pyridinamine, 4,6-dimethyl-
• Synonyms: 6-Amino-2,4-lutidine; 4,6-Dimethylpyridin-2-amine; 2-Amino-4,6-dimethylpyridine 97%; 2-Amino-4,6-dimethylpyridine; 4,6-dimethylpyridin-2-amine; 2-Amino-4,6-dimethylpyridine; 6-氨基-2,4-卢剔啶; 2-氨基-4,6-二甲基吡啶

Database IDs

• CAS Number: 5407-87-4
• EC Number: 226-470-9
• MDL Number: MFCD00006322
• PubChem SID: 24890952; 162034562
• PubChem CID: 21507

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.73884064
• LogD (pH = 7.4): 0.21044582
• Log P: 1.1658965
• Molar Refractivity: 38.5477 cm^3
• Polarizability: 14.099048 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 63 - 64°C; 63-64 °C(lit.); 63-64°C
• Boiling Point: 235 °C(lit.); 235°C
• Flash Point: 121°C
• Hydrophobicity(logP): 0.039

Safety Information

• Storage Warning: Harmful/Irritant/Store under Argon/Keep Cold; IRRITANT
• RTECS: US1818000
• European Hazard Symbols: Harmful (Xn)
• German water hazard class: 3
• Risk Statements: 22-36/37/38
• Safety Statements: 26
• TSCA Listed: false
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Pharmacology Properties

• Gene Information: human ... NOS1(4842), NOS2(4843), NOS3(4846)

Product Information

• Purity: 95%; 95+%; 98%; 99%
• Empirical Formula (Hill Notation): C7H10N2

DETAILS

MP Biomedicals - 05211429

MP Biomedicals Rare Chemical collection

Sigma Aldrich - A51807

Packaging
25 g in poly bottle
5 g in glass bottle