| Identification | More | [Name]
4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-(1,1'-biphenyl)-2-carbonitrile | [CAS]
138401-24-8 | [Synonyms]
[1,1'-BIPHENYL]-2-CARBONITRILE, 4'-[(2-BUTYL-4-OXO-1,3-DIAZASPIRO[4.4]NON-1-EN-3-YL)METHYL]-
[1,1'-BIPHENYL]-2-CARBONITRILE-4-[(2-BUTYL-4-OXO-1,3-DIAZASPIRO[4.4]NON-1-EN-3-YL)METHYL]
4'-[(2-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-(1,1'-biphenyl)-2-carbonitrile
4'-[(2-BUTYL-4-OXO-1,3-DIAZASPIRO[4.4]NON-1-EN-3-YL)METHYL]BIPHENYL-2-CARBONITRILE
4'-[(2-N-BUTYL-4-OXO-1,3-DIAZASPIRO[4.4]NON-1-EN-3-YL)METHYL]-[1,1'-BIPHENYL]-2-CARBONITRILE
[1.1'-Biphenyl]-2-carbonitrile-4-[(2-butyl-4-oxo-1.3-diazaspiro[4.4]non-1-en-3-y
4'-[(2-Butyl-4-oxo-1,3-diazasp
4-(2-butyl-1,3-diazaspiro-[4-4] no-1-en-3-yl-methyl)biphenyl-2-carbonitrile
4'-((2-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-ene-3-yl)methyl)(1,1'-biphenyl)-2-carbonitrile
[1,1'-Biphenyl]-2-carbonitrile,4'-[(2-butyl-4-oxo-1,3-
diazaspiro[4.4]non-1-en-3-yl)methyl]- | [EINECS(EC#)]
423-500-4 | [Molecular Formula]
C25H27N3O | [MDL Number]
MFCD06658242 | [Molecular Weight]
385.5 | [MOL File]
138401-24-8.mol |
| Chemical Properties | Back Directory | [Melting point ]
95-97°C | [Boiling point ]
576.5±60.0 °C(Predicted) | [density ]
1.15 | [vapor pressure ]
0Pa at 20℃ | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
soluble in Methanol | [form ]
Crystalline | [pka]
2.45±0.20(Predicted) | [color ]
White to Almost white | [InChI]
InChI=1S/C25H27N3O/c1-2-3-10-23-27-25(15-6-7-16-25)24(29)28(23)18-19-11-13-20(14-12-19)22-9-5-4-8-21(22)17-26/h4-5,8-9,11-14H,2-3,6-7,10,15-16,18H2,1H3 | [InChIKey]
KWEQEHOPDHARIA-UHFFFAOYSA-N | [SMILES]
C1(C2=CC=C(CN3C(=O)C4(CCCC4)N=C3CCCC)C=C2)=CC=CC=C1C#N | [LogP]
3.7 at 20℃ and pH7 | [Surface tension]
72.5mN/m at 1.025mg/L and 20℃ | [CAS DataBase Reference]
138401-24-8(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
N | [Risk Statements ]
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment . | [Safety Statements ]
S60:This material and/or its container must be disposed of as hazardous waste .
S61:Avoid release to the environment. Refer to special instructions safety data sheet . | [RIDADR ]
3077 | [HS Code ]
2933.29.4300 |
| Hazard Information | Back Directory | [Chemical Properties]
4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-(1,1'-biphenyl)-2-carbonitrile is WHite Solid
| [Uses]
4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-(1,1'-biphenyl)-2-carbonitrile is a butyldiazaspirononenone derivative used in the preparation of acetylcholinesterase inhibitors. An impurity found in Irbesartan (I751000).
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