N-benzyl-9H-purin-6-amine

• ChemBase ID: 69940
• Molecular Formular: C12H11N5
• Molecular Mass: 225.24924
• Monoisotopic Mass: 225.10144538
• SMILES: [nH]1cnc2ncnc(c12)NCc1ccccc1
• Canonical SMILES: c1ccc(cc1)CNc1ncnc2c1[nH]cn2
• InChI: InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)
• InChIKey: NWBJYWHLCVSVIJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-benzyl-9H-purin-6-amine; N-benzyl-7H-purin-6-amine
• IUPAC Systematic name: N-(Phenylmethyl)-7H-purin-6-amine
• IUPAC Traditional name: 6-benzylaminopurine; benzyladenine; 6-(benzylamino)purine; N(6)-benzylaminopurine
• Synonyms: Benzyl adenine; 6-Benzyladenine; 6-Benzylaminopurine; N6-Benzyladenine; 6-BAP; BA; 6-Benzylaminopurine; BAP; 6-Benzylaminopurine solution; N6-Benzyladenine; 6-Benzylaminopurine; N^6-Benzyladenine; N-benzyl-9H-purin-6-amine; 6-Benzyladenine; 6-苄氨基嘌呤; N6-苄基腺嘌呤; N6-苄基腺嘌呤; 6-苄氨基嘌呤; 6-苄氨基嘌呤 溶液; 6-苄基腺嘌呤

Database IDs

• CAS Number: 1214-39-7
• EC Number: 214-927-5; 231-791-2
• MDL Number: MFCD00005572; MFCD00051031
• Beilstein Number: 19406
• PubChem SID: 24848020; 24891717; 24891695; 162035665
• PubChem CID: 62389
• CHEBI ID: 29022
• CHEMBL: 228862
• Chemspider ID: 56177
• KEGG ID: C11263
• Wikipedia Title: 6-Benzylaminopurine

CALCULATED PROPERTIES

• Acid pKa: 9.867655
• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 1.361434
• LogD (pH = 7.4): 1.4897797
• Log P: 1.4951645
• Molar Refractivity: 66.7053 cm^3
• Polarizability: 24.771631 Å^3
• Polar Surface Area: 66.49 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: White to off-white powder
• Melting Point: 229-233°C; 230-233 °C; 230-233 °C(lit.); 230-233°C; 232 - 234°C
• Hydrophobicity(logP): 2.045

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• Storage Warning: Harmful; IRRITANT
• RTECS: AU6252200
• European Hazard Symbols: X; Irritant (Xi)
• German water hazard class: 2; nwg
• Risk Statements: 22; 36/37/38
• Safety Statements: 26-36; 36
• TSCA Listed: false; 是
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H302; H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338; P280F-P330
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves; Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US)
• Storage Temperature: 2-8°C

Product Information

• Purity: ≥99.0% (HPLC); 95%; 95+%; 98%; 99%
• Concentration: 1 mg/mL
• Grade: ReagentPlus®
• Suitability: plant cell culture tested
• Ignition Residue: ≤0.05%
• Cation Traces: Ca: ≤10 mg/kg; Cd: ≤5 mg/kg; Co: ≤5 mg/kg; Cr: ≤5 mg/kg; Cu: ≤5 mg/kg; Fe: ≤5 mg/kg; K: ≤50 mg/kg; Mg: ≤5 mg/kg; Mn: ≤5 mg/kg; Na: ≤5000 mg/kg; Ni: ≤5 mg/kg; Pb: ≤5 mg/kg; Zn: ≤5 mg/kg
• Antion Traces: sulfate (SO42-): ≤150 mg/kg
• Sterility: sterile-filtered
• Quality Level: GMP
• Empirical Formula (Hill Notation): C12H11N5

DETAILS

MP Biomedicals - 02100912

Crystalline
Inhibitor of respiratory kinase
in plants. Increases post-harvest life of green vegetables.

Sigma Aldrich - B3274

Application
6-Benzylaminopurine, benzyl adenine (BAP) is a synthetic cytokinin which together with auxins elicits plant growth and development responses. BAP is a widely used cytokinin supplement to plant growth media such as Murashige and Skoog medium, Gamborg’s B5 medium, and Chu’s N6 medium.
Biochem/physiol Actions
BAP is an inhibitor of respiratory kinase in plants, and increases post-harvest life of green vegetables.

Sigma Aldrich - B3408

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Application
6-Benzylaminopurine, benzyl adenine (BAP) is a synthetic cytokinin which together with auxins elicits plant growth and development responses. BAP is a widely use cytokinin supplement to plant growth media such as Murashige and Skoog medium, Gamborg’s medium, and Chu’s N6 medium.
Biochem/physiol Actions
BAP is an inhibitor of respiratory kinase in plants, and increases post-harvest life of green vegetables.

Sigma Aldrich - 852430

Packaging
5 g in glass bottle

Sigma Aldrich - 13151

Packaging
1, 5, 25 g in glass bottle
Legal Information
ReagentPlus is a registered trademark of Sigma-Aldrich Co. LLC

Sigma Aldrich - 13153

Analysis Note
plant cell culture tested
Other Notes
Plant cell division factor. Studies on growth regulators in tissue culture media in the presence of active charcoal.1