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ChemicalBook--->CAS DataBase List--->109113-72-6

109113-72-6

109113-72-6 Structure

109113-72-6 Structure
IdentificationBack Directory
[Name]

2-(chloromethyl)-4-methylquinazoline
[CAS]

109113-72-6
[Synonyms]

Linaint-I
Linagliptin INT3
Linagliptin Impurity 67
Linagliptin interMediate A
CHLOROMETHYL)-4-METHYLQUINAZOLINE
2-chloroMethyl-4-Methyl quinaoline
2-(chloromethyl)-4-methylquizoline
Linagliptin 2-Chloromethyl Impurity
2-(chloromethyl)-4-methylquinazolin
2-(chloromethyl)-4-methylquinazoline
Quinazoline,2-(chloroMethyl)-4-Methyl-
2-(Chloromethyl)-4-methylquinazoline >
2-(Chloromethyl)-4-methylquinazoline (2-CMQ)
Linagliptin Impurity 35(Not Continued,see C4X-110132)
2-(chloromethyl)-4-methylquinazoline ISO 9001:2015 REACH
Linagliptin intermediates,2-(chloromethyl)-4-methylquinazoline
2-(Chloromethyl)-4-Methylquinazoline / Linagliptin Intermediate
Linagliptin intermediate Quinazoline, 2-(chloromethyl)-4-methyl-
(2-(chloromethyl)-4-methylquinazoline),2-(chloromethyl)-4-methylquinazoline
2-(chloromethyl)-4-methylquinazolineQ: What is 2-(chloromethyl)-4-methylquinazoline Q: What is the CAS Number of 2-(chloromethyl)-4-methylquinazoline Q: What is the storage condition of 2-(chloromethyl)-4-methylquinazoline
[EINECS(EC#)]

1308068-626-2
[Molecular Formula]

C10H9ClN2
[MDL Number]

MFCD09807547
[MOL File]

109113-72-6.mol
[Molecular Weight]

192.645
Chemical PropertiesBack Directory
[Melting point ]

61.0 to 65.0 °C
[Boiling point ]

240.0±32.0 °C(Predicted)
[density ]

1.251
[vapor pressure ]

0Pa at 20℃
[storage temp. ]

Keep in dark place,Inert atmosphere,2-8°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

powder to crystal
[pka]

1.86±0.50(Predicted)
[color ]

Light yellow to Yellow to Orange
[Water Solubility ]

3.11g/L at 20℃
[λmax]

318nm(EtOH)(lit.)
[InChIKey]

UHCUBOJGMLASBY-UHFFFAOYSA-N
[LogP]

1.9 at 25℃
Safety DataBack Directory
[RIDADR ]

3261
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

2933998090
Hazard InformationBack Directory
[Chemical Properties]

White to yellow powder
[Uses]

2-(Chloromethyl)-4-methylquinazoline, is a building block used for the preparation of Linagliptin (L465900), and its impurities, acting as type 2 diabetes drugs.
[Synthesis Reference(s)]

Journal of Heterocyclic Chemistry, 23, p. 1263, 1986 DOI: 10.1002/jhet.5570230458
[Flammability and Explosibility]

Notclassified
[Synthesis]

Into a 500ml reaction flask, add o-aminoacetophenone, chloroacetonitrile, 1,4-dioxane, and N-methyl-3(3-sulfopropyl)imidazolium hydrogen sulfate prepared above. Stir to dissolve, cool the reaction system to 8°C, and dropwise add hydrochloric acid to the reaction system. The reaction temperature was kept unchanged during the dropwise addition. After that, the reaction was continued at 8°C for 18 hours to complete the reaction process. After the reaction, ammonia water (the concentration of ammonia water was 10wt%) at 5°C was added to the reaction system. After stirring and crystallizing at 5 for 30 minutes, filter to obtain a filter cake, washing the filter cake with water. Recrystallized with 200ml of dichloromethane to obtain 2-(chloromethyl)-4-methylquinazoline. yield: 85.14%
2-(chloromethyl)-4-methylquinazoline
Spectrum DetailBack Directory
[Spectrum Detail]

2-(chloromethyl)-4-methylquinazoline(109113-72-6)1HNMR
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