6-Benzylaminopurine CAS#1214-39-7

6-Benzylaminopurine Chemical Properties

Boiling point 

145 °C(lit.)

density 

0.899 g/mL at 20 °C

vapor density 

>1 (vs air)

vapor pressure 

3.3 mm Hg ( 20 °C)

refractive index 

n20/D 1.418(lit.)

Fp 

103 °F

storage temp. 

2-8°C

solubility 

H2O: soluble

form 

Liquid

pka

9.36±0.20(Predicted)

color 

White to very faint yellow

Odor

Characteristic acrylic.

Water Solubility 

Soluble in water, methanol and acetone. Slightly soluble in ethyl acetate and dichloromethane and toluene. Insoluble in n-hexane.

BRN 

19406

Stability:

Stable. Incompatible with strong oxidizing agents.

Major Application

food and beverages

Cosmetics Ingredients Functions

HAIR CONDITIONING

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

SMILES

C(Nc1ncnc2nc[nH]c12)c3ccccc3

LogP

1.570

CAS DataBase Reference

1214-39-7(CAS DataBase Reference)

NIST Chemistry Reference

1H-purin-6-amine, n-(phenylmethyl)-(1214-39-7)

EPA Substance Registry System

N-Benzyladenine (1214-39-7)

Safety Information

Risk Statements 

36/37/38-20/21/22-22

Safety Statements 

9-24/25-37/39-26-36-23

RIDADR 

UN 2348 3/PG 3

WGK Germany 

3

RTECS 

UD3150000

F 

8

TSCA 

TSCA listed

HS Code 

29335995

Storage Class

11 - Combustible Solids

Hazard Classifications

Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 2
Repr. 2

Hazardous Substances Data

1214-39-7(Hazardous Substances Data)

Toxicity

LD50 orl-rat: 2125 mg/kg TOIZAG 19,336,72