ChemicalBook > CAS DataBase List > 2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile

2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile

Product Name
2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile
CAS No.
675126-26-8
Chemical Name
2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile
Synonyms
Gefitinib PI-1;Gefitinib Impurity 44;5-(2-morpholinoethoxy)-4-methoxy-2-nitrobenzonitrile;-nitro-4-methoxy-5-(3-morpholinopropoxy)benzonitrile;4-Methoxy-2-nitro-5-(3-Morpholinopropoxy)benzonitrile;2-Nitro-4-Methoxy-5-(3-Morpholinopropoxy)benzonitrile;4-methoxy-5-(3-morpholinopropoxy)-2-nitrobenzonitrile;2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile;3-methoxy-4-(3-morpholinopropoxy)-2-nitrobenzonitrile;2-Amino-4-methoxy-5- (3-morpholin-propyloxy) benzonitrile
CBNumber
CB22469920
Molecular Formula
C15H19N3O5
Formula Weight
321.33
MOL File
675126-26-8.mol
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2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile Property

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
InChIKey
FYCDMKYKGPHRFW-UHFFFAOYSA-N
SMILES
C(#N)C1=CC(OCCCN2CCOCC2)=C(OC)C=C1[N+]([O-])=O
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Safety

HS Code 
2934999090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

AK Scientific
Product number
J56800
Product name
4-Methoxy-5-(3-morpholinopropoxy)-2-nitrobenzonitrile
Packaging
5g
Price
$110
Updated
2021/12/16
AK Scientific
Product number
J56800
Product name
4-Methoxy-5-(3-morpholinopropoxy)-2-nitrobenzonitrile
Packaging
10g
Price
$198
Updated
2021/12/16
American Custom Chemicals Corporation
Product number
CHM0070028
Product name
2-AMINO-4-METHOXY-5-(3-MORPHOLINOPROPOXY)BENZONITRILE
Purity
95.00%
Packaging
5MG
Price
$501.68
Updated
2021/12/16
Ambeed
Product number
A181163
Product name
4-Methoxy-5-(3-morpholinopropoxy)-2-nitrobenzonitrile
Purity
97%
Packaging
1g
Price
$7
Updated
2021/12/16
Ambeed
Product number
A181163
Product name
4-Methoxy-5-(3-morpholinopropoxy)-2-nitrobenzonitrile
Purity
97%
Packaging
5g
Price
$22
Updated
2021/12/16
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2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile Chemical Properties,Usage,Production

Uses

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.

Synthesis

675126-28-0

675126-26-8

General procedure for the synthesis of 4-methoxy-5-(3-morpholinopropoxy)-2-nitrobenzonitrile from 4-methoxy-3-(3-morpholinopropoxy)benzonitrile: In a 250 mL single-necked flask, 13.0 g (47.0 mmol) of 4-methoxy-3-(3-morpholinopropoxy)benzonitrile and 17 mL of concentrated nitric acid (65%, 376 mmol) were added followed by 17 mL of glacial acetic acid was added. The mixture was stirred at room temperature for about 2 hours until a large amount of solid precipitated, and stirring was continued for 1 hour. Upon completion of the reaction, 52 g of ice water was added to the reaction mixture and stirring was continued for 30 minutes. The solid product was collected by diafiltration and the filter cake was washed with ice water to a pH of about 7. After drying, 14.4 g of white solid product was obtained in 95.3% yield.

References

[1] Bioorganic and Medicinal Chemistry Letters, 2006, vol. 16, # 15, p. 4102 - 4106
[2] Patent: CN107586279, 2018, A. Location in patent: Paragraph 0008; 0017
[3] Patent: CN105503749, 2016, A. Location in patent: Paragraph 0051; 0052
[4] Molecules, 2017, vol. 22, # 10,
[5] Heterocycles, 2007, vol. 71, # 1, p. 39 - 48

2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile manufacturers

Shaanxi Dideu Medichem Co. Ltd
Product
2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrile 675126-26-8
Price
US $0.10/KG
Min. Order
1KG
Purity
99.0%
Supply Ability
1000 tons
Release date
2020-04-24
Shaanxi Dideu Medichem Co. Ltd
Product
2-Nitro-4-Methoxy-5-(3-Morpholinopropoxy)benzonitrile 675126-26-8
Price
US $0.00-0.00/KG
Min. Order
100g
Purity
99%+
Supply Ability
200 tons
Release date
2019-12-27
Shaanxi Dideu Medichem Co. Ltd
Product
2-Nitro-4-Methoxy-5-(3-Morpholinopropoxy)benzonitrile 675126-26-8
Price
US $0.00-0.00/Kg
Min. Order
1KG
Purity
99.0%+
Supply Ability
100 tons
Release date
2020-01-15

675126-26-8, 2-Amino-4-methoxy-5-(3-morpholinopropoxy)benzonitrileRelated Search:

4,4'-(propane-1,3-diyl)bismorpholine 4-Defluoro-4-hydroxy Gefitinib 4-Methoxy-5-(3-Morpholinopropoxy)-2-nitrobenzaMide Gefitinib-d6 4-methoxy-3-(3-morpholinopropoxy)-2-nitrobenzonitrile Gefitinib N-Oxide Gefitinib Impurity 35 N-(3-chloro-4-fluorophenyl)-7 -methoxy-6-(3-morpholinopropoxy)-N-(3-morpholinopropyl)quinazolin-4-amine Gefitinib 3,4-Difluoro Impurity HCl 6,7-Dimethoxy-3,4-dihydroquinazoline-4-one Gefitinib Impurity 8 Gefitinib Chloro Impurity Gefitinib Impurity 11 Gefitinib 6-Hydroxy-7-methoxy-3,4-dihydroquinazolin-4-one 4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-ol 7-Methoxy-6-(3-morpholin-4-ylpropoxy)quinazolin-4(3H)-one 3,4-Dihydro-7-methoxy-4-oxoquinazolin-6-yl acetate

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  • 2-Nitro-4-Methoxy-5-(3-Morpholinopropoxy)benzonitrile
  • 4-Methoxy-2-nitro-5-(3-Morpholinopropoxy)benzonitrile
  • 4-METHOXY-5-(3-MORPHOLINOPROPOXY) -2-NITROBENZONITRILE _675126-26-8
  • Gefitinib PI-1
  • 4-Methoxy-5-(3-Morpholinopropoxy)-2-Nitrobenzonitrile Gefitinib HCL InterMediates G4
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  • -nitro-4-methoxy-5-(3-morpholinopropoxy)benzonitrile
  • 4-Methoxy-5-(3-morpholin-4-yl-propoxy)-2-nitro-benzonitriLE
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  • Gefitinib Impurity 44
  • 4-methoxy-5-[3-(morpholin-4-yl)propoxy]-2- nitro benzonitrile (GFT-III)
  • 3-methoxy-4-(3-morpholinopropoxy)-2-nitrobenzonitrile
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  • 675126-26-8