2311-46-8
2311-46-8 structure
- Name: N-caproic acid isopropyl ester
- Chemical Name: propan-2-yl hexanoate
- CAS Number: 2311-46-8
- Molecular Formula: C9H18O2
- Molecular Weight: 158.23800
- Catalog: Flavors and spices Synthetic spice Carboxylic acid and ester perfume Aliphatic carboxylate
- Create Date: 2018-02-27 08:00:00
- Modify Date: 2025-08-26 16:49:00
| Name | propan-2-yl hexanoate |
|---|---|
| Synonyms |
N-CAPROIC ACID ISOPROPYL ESTER
MFCD00059436 Hexansaeure-isopropylester Hexanoic acid,1-methylethyl ester Isopropyl caproate 1-Methylethyl hexanoate i-propyl hexanoate Hexanoic Acid Isopropyl Ester isopropyl hexanoate Isopropyl capronate EINECS 219-000-9 Isopropyl hexylate |
| Density | 0.86 |
|---|---|
| Boiling Point | 168 °C |
| Molecular Formula | C9H18O2 |
| Molecular Weight | 158.23800 |
| Flash Point | 54 °C |
| Exact Mass | 158.13100 |
| PSA | 26.30000 |
| LogP | 2.51830 |
| Vapour Pressure | 1.09mmHg at 25°C |
| Index of Refraction | 1.416 |
| Hazard Codes | F,Xn |
|---|---|
| Risk Phrases | R11:Highly Flammable. R36/37/38:Irritating to eyes, respiratory system and skin . R65:Harmful: May cause lung damage if swallowed. |
| Safety Phrases | S16-S62 |
| RIDADR | UN 2458 3/PG 2 |
| WGK Germany | 3 |
| RTECS | MM1997800 |
| Hazard Class | 3.0 |
| HS Code | 2915900090 |
|
~91%
2311-46-8 |
| Literature: Mandal, Arun K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1983 , vol. 22, # 5 p. 505 |
|
~90%
2311-46-8 |
| Literature: Travis, Benjamin R.; Sivakumar, Meenakshi; Hollist, G. Olatunji; Borhan, Babak Organic Letters, 2003 , vol. 5, # 7 p. 1031 - 1034 |
|
~68%
2311-46-8 |
| Literature: Gnanaprakasam, Boopathy; Ben-David, Yehoshoa; Milstein, David Advanced Synthesis and Catalysis, 2010 , vol. 352, # 18 p. 3169 - 3173 |
|
~6%
2311-46-8 |
| Literature: Tohma, Hirofumi; Maegawa, Tomohiro; Kita, Yasuyuki Synlett, 2003 , # 5 p. 723 - 725 |
|
~%
2311-46-8 |
| Literature: Tetrahedron, , vol. 65, # 51 p. 10637 - 10643 |
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~%
2311-46-8 |
| Literature: Synthesis, , p. 223 - 227 |
|
~%
2311-46-8 |
| Literature: Journal of the American Oil Chemists' Society, , vol. 24, p. 257 |
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~%
2311-46-8 |
| Literature: Advanced Synthesis and Catalysis, , vol. 352, # 18 p. 3169 - 3173 |
| Precursor 9 | |
|---|---|
| DownStream 2 | |
| HS Code | 2915900090 |
|---|---|
| Summary | 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0% |