ChemicalBook--->CAS DataBase List--->171096-33-6

171096-33-6

171096-33-6 Structure

171096-33-6 Structure
IdentificationBack Directory
[Name]

Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate
[CAS]

171096-33-6
[Synonyms]

Methyl 4,6-Dichloropyrimidine-5-acetate
Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate
5-Pyrimidineacetic acid, 4,6-dichloro-, methyl ester
[Molecular Formula]

C7H6Cl2N2O2
[MDL Number]

MFCD20526414
[MOL File]

171096-33-6.mol
[Molecular Weight]

221.041
Chemical PropertiesBack Directory
[Boiling point ]

305.9±37.0 °C(Predicted)
[density ]

1.448±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[pka]

-4.41±0.50(Predicted)
[InChI]

InChI=1S/C7H6Cl2N2O2/c1-13-5(12)2-4-6(8)10-3-11-7(4)9/h3H,2H2,1H3
[InChIKey]

ORHWGOUAAWDYFP-UHFFFAOYSA-N
[SMILES]

C1=NC(Cl)=C(CC(OC)=O)C(Cl)=N1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H335-H319-H315-H302
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Questions And AnswerBack Directory
[Application]

4,6-Dichloropyrimidine-5-acetic acid methyl ester is a pharmaceutical intermediate that can be prepared in three steps from diethyl malonate and ethyl bromoacetate as starting materials. It can be used in laboratory research and development processes as well as in chemical production processes.
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate(171096-33-6)1HNMR
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