N6-(delta 2-Isopentenyl)-adenine supplier

Name
N6-(delta 2-Isopentenyl)-adenine
EINECS 812-988-8
CAS No. 2365-40-4
Article Data18
CAS DataBase
Density 1.267 g/cm³
Solubility
Melting Point 218-220 °C
Formula C₁₀H₁₃N₅
Boiling Point 477.144 °C at 760 mmHg
Molecular Weight 203.247
Flash Point 242.368 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1H-Purin-6-amine,N-(3-methyl-2-butenyl)- (9CI);Adenine, N-(3-methyl-2-butenyl)- (7CI,8CI);6-(3-Methyl-2-buten-1-ylamino)purine;6-(D2-Isopentenylamino)purine;6-(g,g-Dimethylallylamino)purine;6-Isopentenyladenine;6-N-(3-Methylbut-2-enylamino)purine;6-[(3-Methyl-2-butenyl)amino]purine;Bryokinin;Enadenine;Isopentenyladenine;N-(3-Methyl-2-butenyl)-1H-purin-6-amine;N-(3-Methyl-2-butenyl)adenine;N-(g,g-Dimethylallyl)adenine;N6-(2-Isopentenyl)adenine;N6-(3-Methyl-2-butenyl)adenine;N6-(D2-Isopentenyl)adenine;N6-(D2-Isopentenyl)aminopurine;N6-(g,g-Dimethylallyl)aminopurine;N6-Isopentenyladenine;NSC106958;N6-(delta 2-Isopentenyl)-adenine;
PSA 66.49000
LogP 1.80400

N6-(delta 2-Isopentenyl)-adenine Specification

The N6-(delta 2-Isopentenyl)-adenine, with the CAS registry number 2365-40-4, is also known as N6-(2-Isopentenyl)-adenine. This chemical's molecular formula is C₁₀H₁₃N₅ and molecular weight is 203.24. What's more, its systematic name is N-(3-Methyl-2-buten-1-yl)-7H-purin-6-amine. This chemical is used as a kind of plant growth regulator.

Physical properties of N6-(delta 2-Isopentenyl)-adenine are: (1)ACD/LogP: 2.332; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.32; (4)ACD/LogD (pH 7.4): 2.33; (5)ACD/BCF (pH 5.5): 34.15; (6)ACD/BCF (pH 7.4): 34.76; (7)ACD/KOC (pH 5.5): 433.23; (8)ACD/KOC (pH 7.4): 441.02; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 66.49 Å²; (13)Index of Refraction: 1.683; (14)Molar Refractivity: 60.844 cm³; (15)Molar Volume: 160.442 cm³; (16)Polarizability: 24.12×10^-24cm³; (17)Surface Tension: 64.4 dyne/cm; (18)Density: 1.267 g/cm³; (19)Flash Point: 242.368 °C; (20)Enthalpy of Vaporization: 74.1 kJ/mol; (21)Boiling Point: 477.144 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c(c2c(nc1)ncn2)NC\C=C(/C)C
(2)Std. 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)
(3)Std. InChIKey: HYVABZIGRDEKCD-UHFFFAOYSA-N

Product Name

N6-(delta 2-Isopentenyl)-adenine

N6-(delta 2-Isopentenyl)-adenine Specification

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