Introduction:Basic information about CAS 123808-97-9|(3R-CIS)-(-)-3-ISOPROPYL-7A-METHYLTETRAHYDROPYRROLO[2,1-B]OXAZOL-5(6H)-ONE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3R-CIS)-(-)-3-ISOPROPYL-7A-METHYLTETRAHYDROPYRROLO[2,1-B]OXAZOL-5(6H)-ONE |
|---|
| CAS Number | 123808-97-9 | Molecular Weight | 183.24700 |
|---|
| Density | 1.09g/cm3 | Boiling Point | 82ºC (0.7 mmHg) |
|---|
| Molecular Formula | C10H17NO2 | Melting Point | 59-60ºC |
|---|
| MSDS | / | Flash Point | 58.3ºC |
|---|
Names
| Name | (3R,7aS)-7a-methyl-3-propan-2-yl-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]oxazol-5-one |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.09g/cm3 |
|---|
| Boiling Point | 82ºC (0.7 mmHg) |
|---|
| Melting Point | 59-60ºC |
|---|
| Molecular Formula | C10H17NO2 |
|---|
| Molecular Weight | 183.24700 |
|---|
| Flash Point | 58.3ºC |
|---|
| Exact Mass | 183.12600 |
|---|
| PSA | 29.54000 |
|---|
| LogP | 1.31770 |
|---|
| Vapour Pressure | 0.0126mmHg at 25°C |
|---|
| Index of Refraction | 1.472-1.474 |
|---|
| InChIKey | NUUDVADIQSLTCN-WPRPVWTQSA-N |
|---|
| SMILES | CC(C)C1COC2(C)CCC(=O)N12 |
|---|
Safety Information
| Hazard Codes | Xn |
|---|
| Risk Phrases | R20/21/22 |
|---|
| Safety Phrases | S36-S37 |
|---|
Synonyms
| InChI=1/C10H17NO2/c1-7(2)8-6-13-10(3)5-4-9(12)11(8)10/h7-8H,4-6H2,1-3H3/t8-,10-/m0/s |
| (3R-CIS)-(-)-3-ISOPROPYL-7A-METHYLTETRAHYDROPYRROLO[2,1-B]OXAZOL-5(6H)-ONE |
| (3R-cis)-(-)-3-Isopropyl-7a-methyltetrahydropyrrolo-[2,1-b]oxazol-5(6H)-one |
| (3R,7aS)-7a-methyl-3-propan-2-yl-2,3,6,7-tetrahydropyrrolo[2,1-b]oxazol-5-one |