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59864-30-1

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59864-30-1 Structure

59864-30-1 Structure
IdentificationMore
[Name]

2,4-DIMETHOXYPYRIMIDINE-6-CARBOXYLIC ACID
[CAS]

59864-30-1
[Synonyms]

2,4-DIMETHOXYPYRIMIDINE-6-CARBOXYLIC ACID
2,6-DIMETHOXYPYRIMIDINE-4-CARBOXYLIC ACID
ASINEX-REAG BAS 02085805
TIMTEC-BB SBB010109
[Molecular Formula]

C7H8N2O4
[MDL Number]

MFCD01568105
[Molecular Weight]

184.15
[MOL File]

59864-30-1.mol
Chemical PropertiesBack Directory
[Melting point ]

162
[Boiling point ]

93-98°C/0.3mm
[density ]

1.349±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

2.85±0.30(Predicted)
[color ]

White
[InChI]

InChI=1S/C7H8N2O4/c1-12-5-3-4(6(10)11)8-7(9-5)13-2/h3H,1-2H3,(H,10,11)
[InChIKey]

APCAETLUMQRTDK-UHFFFAOYSA-N
[SMILES]

C1(OC)=NC(OC)=CC(C(O)=O)=N1
[CAS DataBase Reference]

59864-30-1(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xi
[Hazard Note ]

Irritant
[HS Code ]

2933599590
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Methanol-->Diethyl ether-->Sodium-->Phosphorus oxitrichloride-->N,N-Dimethylaniline-->Orotic acid-->2-methylpentane
Hazard InformationBack Directory
[Uses]

2,4-Dimethoxypyrimidine-6-carboxylic Acid is a reactant or reagent in the synthetic preparation of racemic cylindrospermopsin.
Spectrum DetailBack Directory
[Spectrum Detail]

2,4-DIMETHOXYPYRIMIDINE-6-CARBOXYLIC ACID(59864-30-1)1HNMR
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