ChemicalBook--->CAS DataBase List--->14160-93-1

14160-93-1

14160-93-1 Structure

14160-93-1 Structure
IdentificationBack Directory
[Name]

4-AMINO-6-CHLORO-PYRIMIDINE-5-CARBALDEHYDE
[CAS]

14160-93-1
[Synonyms]

RARECHEM AK ML 0569
4-aMino-6-chloropyriMidin-5-carbaldehyde
4-AMINO-6-CHLORO-5-PYRIMIDINECARBALDEHYDE
4-Chloro-6-aminopyrimidine-5-carbaldehyde
4-aMino-6-chloro-pyriMidine-5-carbaledhyde
5-PyriMidinecarbaldehyde, 4-aMino-6-chloro
4-AMINO-6-CHLORO-PYRIMIDINE-5-CARBALDEHYDE
4-AMINO-6-CHLORO-5-PYRIMIDINECARBOXALDEHYDE
4-Amino-6-chloropyrimidine-5-carboxaldehyde
5-PyriMidinecarboxaldehyde, 4-aMino-6-chloro-
4-Amino-6-chloropyrimidine-5-carboxaldehyde,97%
4-Amino-6-chloro-5-pyrimidinecarboxaldehyde ,96%
4-AMINO-6-CHLORO-PYRIMIDINE-5-CARBALDEHYDE ISO 9001:2015 REACH
4-Amino-6-chloro-5-formylpyrimidine, 4-Amino-6-chloro-5-formyl-1,3-diazine
[EINECS(EC#)]

238-005-7
[Molecular Formula]

C5H4ClN3O
[MDL Number]

MFCD03789626
[MOL File]

14160-93-1.mol
[Molecular Weight]

157.56
Chemical PropertiesBack Directory
[Melting point ]

>300°C
[Boiling point ]

355.9±42.0 °C(Predicted)
[density ]

1.548±0.06 g/cm3(Predicted)
[storage temp. ]

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

Solid
[pka]

0.72±0.10(Predicted)
[Appearance]

Off-white to light yellow Solid
[Sensitive ]

Air Sensitive
[InChI]

InChI=1S/C5H4ClN3O/c6-4-3(1-10)5(7)9-2-8-4/h1-2H,(H2,7,8,9)
[InChIKey]

GOJNFUXEBVBARW-UHFFFAOYSA-N
[SMILES]

C1=NC(Cl)=C(C=O)C(N)=N1
[EPA Substance Registry System]

5-Pyrimidinecarboxaldehyde, 4-amino-6-chloro- (14160-93-1)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280a-P304+P340-P305+P351+P338-P405-P501a
[Hazard Codes ]

Xi
[Risk Statements ]

43-36/37/38
[Safety Statements ]

36/37-36/37/39-26
[TSCA ]

Yes
[HazardClass ]

IRRITANT
[HS Code ]

29335990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

N,N-Dimethylformamide-->Toluene-->Phosphorus oxitrichloride-->4,6-Dihydroxypyrimidine
Hazard InformationBack Directory
[Chemical Properties]

Yellow solid
[Uses]

4-Amino-6-chloropyrimidine-5-carbaldehyde is an important pharmaceutical intermediate compound that can be used in the preparation of ENPP1 inhibitors [1]. Furthermore, it serves as a key starting material for the synthesis of novel 4-amino-pyrimidine-5-formyl oxime VEGFR-2 inhibitors [2].
[References]

[1] Sun, Y., Chen, M., Han, Y. (2024). Discovery of Pyrido[2,3-d]pyrimidin-7-one Derivatives as Highly Potent and Efficacious Ectonucleotide Pyrophosphatase/Phosphodiesterase 1 (ENPP1) Inhibitors for Cancer Treatment. Journal of Medicinal Chemistry, 67 5, 3986–4006. https://doi.org/10.1021/acs.jmedchem.3c02288
[2] Huang, S., Li, R., LaMontagne, K. R., Greenberger, L. M., & Connolly, P. J. (2011). 4-Aminopyrimidine-5-carbaldehyde oximes as potent VEGFR-2 inhibitors. Part II. Bioorganic & Medicinal Chemistry Letters, 21 6, Pages 1815-1818. https://doi.org/10.1016/j.bmcl.2011.01.053
Spectrum DetailBack Directory
[Spectrum Detail]

4-AMINO-6-CHLORO-PYRIMIDINE-5-CARBALDEHYDE(14160-93-1)1HNMR
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