CAS Number89771-75-5
Synonyms(3R,4S,5R)-4-hydroxy-5-(3-hydroxy-3-oxoprop-1-en-2-yl)oxy-3-phosphonooxycyclohexene-1-carboxylic acid; (3R,4S,5R)-5-(1-carboxyethenoxy)-4-hydroxy-3-phosphonooxy-cyclohexene-1-carboxylic acid; (3R,4S,5R)-5-(1-carboxyethenoxy)-4-hydroxy-3-phosphonooxy-1-cyclohexenecarboxylic acid; (3R,4S,5R)-4-hydroxy-5-(3-hydroxy-3-oxo-prop-1-en-2-yl)oxy-3-phosphonooxy-cyclohexene-1-carboxylic acid; 1-Cyclohexene-1-carboxylic acid, 5-[(1-carboxyethenyl)oxy]-4-hydroxy-3-(phosphonooxy)-, [3R-(3alpha,4alpha,5beta)]-
Molecular FormulaC10H13O10P
Molecular Weight324.18
Purity98%
Density1.75±0.1 g/cm3(Predicted)
Boiling Point724.0±70.0 °C(Predicted)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 89771-75-5 |
| Catalog No. | 2A-1166885 |
| Chinese Name | 3-溴苯基哌嗪盐酸盐 |
| Synonyms | (3R,4S,5R)-4-hydroxy-5-(3-hydroxy-3-oxoprop-1-en-2-yl)oxy-3-phosphonooxycyclohexene-1-carboxylic acid; (3R,4S,5R)-5-(1-carboxyethenoxy)-4-hydroxy-3-phosphonooxy-cyclohexene-1-carboxylic acid; (3R,4S,5R)-5-(1-carboxyethenoxy)-4-hydroxy-3-phosphonooxy-1-cyclohexenecarboxylic acid; (3R,4S,5R)-4-hydroxy-5-(3-hydroxy-3-oxo-prop-1-en-2-yl)oxy-3-phosphonooxy-cyclohexene-1-carboxylic acid; 1-Cyclohexene-1-carboxylic acid, 5-[(1-carboxyethenyl)oxy]-4-hydroxy-3-(phosphonooxy)-, [3R-(3alpha,4alpha,5beta)]- |
| Molecular Formula | C10H13O10P |
| Molecular Weight | 324.18 |
| Purity | 98 |
| Density | 1.75±0.1 g/cm3(Predicted) |
| Boiling Point | 724.0±70.0 °C(Predicted) |
| PubChem ID | 4488 |
| SMILES | C=C(OC1CC(C(=O)O)=CC(OP(=O)(O)O)C1O)C(=O)O |
| InChI | InChI=1S/C10H13O10P/c1-4(9(12)13)19-6-2-5(10(14)15)3-7(8(6)11)20-21(16,17)18/h3,6-8,11H,1-2H2,(H,12,13)(H,14,15)(H2,16,17,18)/t6-,7-,8+/m1/s1 |
| InChI Key | QUTYKIXIUDQOLK-PRJMDXOYSA-N |
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