3-(2,4-dioxopyrimidin-1-yl)propanenitrile
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Basic information
- CAS
2864-27-9- Standard SMILES
N#CCCn1ccc(=O)[nH]c1=O- InChIKey
SNWDPCVMGIGCNX-UHFFFAOYSA-N- Molecular formula
- C7H7N3O2
- Average molar mass
- 165.15 g/mol
Names & identifiers
- Preferred name
- 3-(2,4-dioxopyrimidin-1-yl)propanenitrile
- English name
- 3-(2,4-dioxopyrimidin-1-yl)propanenitrile
- Molecular formula
- C7H7N3O2
- Molecular weight
- 165.15
Names & synonyms
3-(2,4-dioxopyrimidin-1-yl)propanenitrile1(2H)-Pyrimidinepropanenitrile, 3,4-dihydro-2,4-dioxo-3-(2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)propanenitrile3-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)propanenitrile
Database identifiers
- CAS
2864-27-9- PubChem CID
- 1940239
- ChEMBL
CHEMBL4534158- EC Number
- 116-279-8
- Nikkaji
- J1.229.057H
Properties
Physicochemical properties
- Melting point
- 230 · 230-231 °C(Solv: water (7732-18-5))
- Density
- 1.297 · 1.297±0.06 g/cm3(Predicted)
- pka
- 9.51 · 9.51±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
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Related reactions
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Compound notes
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