N-Isopentenyladenine - CAS 2365-40-4
Catalog: |
BB053727 |
Product Name: |
N-Isopentenyladenine |
CAS: |
2365-40-4 |
Synonyms: |
N6-(2-Isopentenyl)adenine; 6-(3,3-Dimethylallylamino)purine; N-(3-Methyl-2-buten-1-yl)-9H-purin-6-amine; 6-(3-Methyl-2-buten-1-ylamino)purine; 6-(Δ2-Isopentenylamino)purine; 6-(γ,γ-Dimethylallylamino)purine; 6-Isopentenyladenine; 6-N-(3-Methylbut-2-enylamino)purine; 6-[(3-Methyl-2-butenyl)amino]purine; Bryokinin; DMAA; Enadenine; IPA; Isopentenyladenine; N-(3-Methyl-2-butenyl)-1H-purin-6-amine; N-(γ,γ-Dimethylallyl)adenine; N6-(3-Methyl-2-butenyl)adenine; N6-(Δ2-Isopentenyl)adenine; N6-(Δ2-Isopentenyl)aminopurine; N6-(γ,γ-Dimethylallyl)aminopurine; N6-Isopentenyladenine; NSC 106958 |
Related CAS: | 177966-67-5 (monohydrochloride)
|
IUPAC Name: | N-(3-methylbut-2-enyl)-7H-purin-6-amine |
Description: | N-Isopentenyladenine is a versatile compound, garnering recognition due to its multifaceted pharmaceutical applications. Its predominant utilization lies in the realm of plant tissue culture, where it functions as a phenomenal cytokinin hormone, effectively stimulating growth and orchestrating plant development. |
Molecular Weight: | 203.25 |
Molecular Formula: | C10H13N5 |
Canonical SMILES: | CC(=CCNC1=NC=NC2=C1NC=N2)C |
InChI: | InChI=1S/C10H13N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h3,5-6H,4H2,1-2H3,(H2,11,12,13,14,15) |
InChI Key: | HYVABZIGRDEKCD-UHFFFAOYSA-N |
Boiling Point: | 318.1±52.0°C (Predicted) |
Melting Point: | 218-220°C |
Purity: | 98% |
Density: | 1.28±0.1 g/cm3 (Predicted) |
Solubility: | Soluble in DMF (Slightly), Methanol (Slightly) |
Appearance: | Solid |
Storage: | Store at -20°C |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 236 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.11709544 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.11709544 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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Amines and Anilines
Purines
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