2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile
- CAS NO.：675126-26-8
- Empirical Formula: C15H19N3O5
- Molecular Weight: 321.33
- MDL number: MFCD11110477
- EINECS: 1806241-263-5
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-07-02 08:55:03
What is 2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile?
The Uses of 2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile
4-Methoxy-5-[3-(morpholin-4-yl)propoxy]-2-nitrobenzonitrile is a useful research chemical compound used in the preparation of carbon-11 iressa as PET cancer imaging agent for epidermal growth factor receptor tyrosine kinase.
Properties of 2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile
| Melting point: | 127℃ |
| Boiling point: | 522.3±50.0 °C(Predicted) |
| Density | 1.29 |
| storage temp. | Sealed in dry,Room Temperature |
| pka | 6.96±0.10(Predicted) |
| form | Solid |
| color | Light yellow to yellow |
| InChI | InChI=1S/C15H19N3O5/c1-21-14-10-13(18(19)20)12(11-16)9-15(14)23-6-2-3-17-4-7-22-8-5-17/h9-10H,2-8H2,1H3 |
Safety information for 2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile
| InChIKey | FYCDMKYKGPHRFW-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC(OCCCN2CCOCC2)=C(OC)C=C1[N+]([O-])=O |
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