![4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-(1,1'-biphenyl)-2-carbonitrile Structure](https://www.chemicalbook.com/CAS/GIF/138401-24-8.gif)
4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-(1,1'-biphenyl)-2-carbonitrile
- Product Name4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-(1,1'-biphenyl)-2-carbonitrile
- CAS138401-24-8
- CBNumberCB4259312
- MFC25H27N3O
- MW385.5
- EINECS604-075-6
- MDL NumberMFCD06658242
- MOL File138401-24-8.mol
- MSDS FileSDS
Chemical Properties
| 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) |
| EWG's Food Scores | 1 |
Safety
| Symbol(GHS) |
 
|
| Signal word | Warning |
| Hazard statements | H302+H312+H332-H315-H319-H410 |
| Precautionary statements | P261-P264-P270-P271-P273-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P391-P501 |
| Hazard Codes | N |
| Risk Statements | 50/53 |
| Safety Statements | 60-61 |
| RIDADR | 3077 |
| HS Code | 2933.29.4300 |
