4-(Heptyloxy)benzonitrile
Modify Date: 2025-08-21 23:36:54
4-(Heptyloxy)benzonitrile structure
|
Common Name | 4-(Heptyloxy)benzonitrile | ||
|---|---|---|---|---|
| CAS Number | 29147-88-4 | Molecular Weight | 217.307 | |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 341.3±15.0 °C at 760 mmHg | |
| Molecular Formula | C14H19NO | Melting Point | 210-212°C | |
| MSDS | N/A | Flash Point | 144.1±14.3 °C | |
| Name | 4-heptoxybenzonitrile |
|---|---|
| Synonym | More Synonyms |
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 341.3±15.0 °C at 760 mmHg |
| Melting Point | 210-212°C |
| Molecular Formula | C14H19NO |
| Molecular Weight | 217.307 |
| Flash Point | 144.1±14.3 °C |
| Exact Mass | 217.146667 |
| PSA | 33.02000 |
| LogP | 5.06 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.504 |
| InChIKey | IVYYVHKDOAVYRW-UHFFFAOYSA-N |
| SMILES | CCCCCCCOc1ccc(C#N)cc1 |
| Hazard Codes | Xi |
|---|---|
| Risk Phrases | R36/37/38:Irritating to eyes, respiratory system and skin . |
| Safety Phrases | S26-S37/39 |
| WGK Germany | 3 |
| HS Code | 2926909090 |
|
~75%
4-(Heptyloxy)be... CAS#:29147-88-4 |
| Literature: RECEPTOS, INC.; BOEHM, Marcus, F.; MARTINBOROUGH, Esther; MOORJANI, Manisha; TAMIYA, Junko; HUANG, Liming; YEAGER, Adam, R.; BRAHMACHARY, Enugurthi; FOWLER, Thomas; NOVAK, Andrew; MEGHANI, Premji; KNAGGS, Michael Patent: WO2013/90454 A2, 2013 ; Location in patent: Paragraph 00249 ; |
|
~85%
4-(Heptyloxy)be... CAS#:29147-88-4 |
| Literature: Tunoori, Ashok Rao; Dutta, Dinah; Georg, Gunda I. Tetrahedron Letters, 1998 , vol. 39, # 48 p. 8751 - 8754 |
|
~73%
4-(Heptyloxy)be... CAS#:29147-88-4 |
| Literature: Gallardo, H.; Begnini, I. M. Molecular Crystals and Liquid Crystals Science and Technology, Section A: Molecular Crystals and Liquid Crystals, 1995 , vol. 258, p. 85 - 94 |
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
| 4-HEPTYLOXYBENZONITRILE |
| 4-heptyloxybenzenecarbonitrile |
| 4-N-heptyloxybenzonitrile |
| Benzonitrile,4-(heptyloxy) |
| 4-(Heptyloxy)benzonitrile |
| 4-n-Heptyloxy-benzonitril |
| Benzonitrile, 4-(heptyloxy)- |
| MFCD00143323 |
| 4-heptoxybenzenecarbonitrile |