1214-39-7
Product Name:
6-Benzylaminopurine
Formula:
C12H11N5
Synonyms:
6-BAP;6-Benzylaminopurine - CAS 1214-39-7 - Calbiochem;BA;Benzyladenine;N6-Benzyladenine
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colorless solid; Technical product is off-white solid; [HSDB] White solid; Formulated as soluble concentrate/liquid; [Reference #1] Light yellow powder; [Alfa Aesar MSDS] |
|---|---|
| Color/Form | Colorless, fine needles |
| Melting Point | 234-235 °C |
| Solubility | Insoluble in most common organic solvents; Soluble in dimethylformamide, dimethyl sulfoxide |
| Vapor Pressure | 2.373X10-6 mPa (1.79X10-11 mm Hg) at 20 °C |
| LogP | log Kow = 1.57 |
| Kovats Retention Index | 2527 |
| Other Experimental Properties | Off-white powder /Technical/ |
| Chemical Classes | Pesticides -> Plant Growth Regulators |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Health Hazard GHS08  Environment GHS09 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P202:Do not handle until all safety precautions have been read and understood. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P273:Avoid release to the environment. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P308+P313:IF exposed or concerned: Get medical advice/attention. |
COMPUTED DESCRIPTORS
| Molecular Weight | 225.25 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 225.10144537 g/mol |
| Monoisotopic Mass | 225.10144537 g/mol |
| Topological Polar Surface Area | 66.5 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 241 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
N-benzyladenine is a member of the class of 6-aminopurines that is adenine in which one of the hydrogens of the amino group is replaced by a benzyl group. It has a role as a plant metabolite and a cytokinin. It is functionally related to an adenine.