ChemicalBook--->CAS DataBase List--->615-77-0

615-77-0

615-77-0 Structure

615-77-0 Structure
IdentificationMore
[Name]

1-METHYLURACIL
[CAS]

615-77-0
[Synonyms]

1-METHYL-1H-PYRIMIDINE-2,4-DIONE
1-METHYL-2,4(1H,3H)-PYRIMIDINEDIONE
1-METHYLPYRIMIDINE-2,4(1H,3H)-DIONE
1-METHYLURACIL
METHYLURACIL
2,4(1H,3H)-Pyrimidinedione, 1-methyl-
[Molecular Formula]

C5H6N2O2
[MDL Number]

MFCD00038666
[Molecular Weight]

126.11
[MOL File]

615-77-0.mol
Chemical PropertiesBack Directory
[Appearance]

Crystalline Solid
[Melting point ]

236-238 °C (lit.)
[Boiling point ]

234.21°C (rough estimate)
[density ]

1.3541 (rough estimate)
[refractive index ]

1.5090 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

1 M NaOH: soluble50mg/mL, clear, colorless
[form ]

Solid
[pka]

9.77±0.10(Predicted)
[color ]

White
[Water Solubility ]

20g/L(temperature not stated)
[InChI]

InChI=1S/C5H6N2O2/c1-7-3-2-4(8)6-5(7)9/h2-3H,1H3,(H,6,8,9)
[InChIKey]

XBCXJKGHPABGSD-UHFFFAOYSA-N
[SMILES]

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

615-77-0(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R40:Limited evidence of a carcinogenic effect.
[Safety Statements ]

S22:Do not breathe dust .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Carc. 2
Hazard InformationBack Directory
[Chemical Properties]

Crystalline Solid
[Uses]

1-Methyluracil (cas# 615-77-0) is a compound useful in organic synthesis.
[Definition]

ChEBI: A pyrimidone that is uracil with a methyl group substituent at position 1.
[General Description]

1-Methyluracil is of special importance in biochemistry, since uracil attaches ribose in ribonucleic acid (RNA) just precisely at the N1 atom. H-bond complex formation between 1-methyluracil and glycine has been investigated by theoretical calculations and FT-IR spectroscopy in Ar matrices. It forms 1:1 complexes with 9-ethyl-8-bromo-2,6-diaminopurine and the complex structure has been determined by three-dimensional X-ray diffraction methods.
Spectrum DetailBack Directory
[Spectrum Detail]

1-METHYLURACIL(615-77-0)1HNMR
1-METHYLURACIL(615-77-0)Raman
1-METHYLURACIL(615-77-0)IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

615-77-0(sigmaaldrich)
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