
CAS Number87321-20-8
SynonymsBenzoic acid, 4-(hexyloxy)-, 4-[[[(1S)-1-methylheptyl]oxy]carbonyl]phenyl ester; 4-{[(2S)-2-Octanyloxy]carbonyl}phenyl 4-(hexyloxy)benzoate; (S)-Octan-2-yl 4-((4-(hexyloxy)benzoyl)oxy)benzoate; 4-{[(2S)-Octan-2-yloxy]carbonyl}phenyl 4-(hexyloxy)benzoate; [4-[(2S)-octan-2-yl]oxycarbonylphenyl] 4-hexoxybenzoate
Molecular FormulaC28H38O5
Molecular Weight454.61
Purity98.00%
Density1.0±0.1 g/cm3
Boiling Point565.8±35.0 °C at 760 mmHg
Melting Point49 °C
AppearanceSolid;White to Almost white powder to crystal
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 87321-20-8 |
| Catalog No. | 2A-9049459 |
| Chinese Name | (S)-Octan-2-yl4-((4-(hexyloxy)benzoyl)oxy)benzoate |
| Synonyms | Benzoic acid, 4-(hexyloxy)-, 4-[[[(1S)-1-methylheptyl]oxy]carbonyl]phenyl ester; 4-{[(2S)-2-Octanyloxy]carbonyl}phenyl 4-(hexyloxy)benzoate; (S)-Octan-2-yl 4-((4-(hexyloxy)benzoyl)oxy)benzoate; 4-{[(2S)-Octan-2-yloxy]carbonyl}phenyl 4-(hexyloxy)benzoate; [4-[(2S)-octan-2-yl]oxycarbonylphenyl] 4-hexoxybenzoate |
| Molecular Formula | C28H38O5 |
| Molecular Weight | 454.61 |
| Purity | 98.00 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 565.8±35.0 °C at 760 mmHg |
| Melting Point | 49 °C |
| Appearance | Solid;White to Almost white powder to crystal |
| Storage Condition | room temperature, dry |
| PubChem ID | 40870620 |
| SMILES | CCCCCCOc1ccc(C(=O)Oc2ccc(C(=O)OC(C)CCCCCC)cc2)cc1 |
| InChI | InChI=1S/C28H38O5/c1-4-6-8-10-12-22(3)32-27(29)23-15-19-26(20-16-23)33-28(30)24-13-17-25(18-14-24)31-21-11-9-7-5-2/h13-20,22H,4-12,21H2,1-3H3/t22-/m0/s1 |
| InChI Key | PLGPDUBTEHIWRH-QFIPXVFZSA-N |
| Transport Info | Product name: 4-[4-(Hexyloxy)benzoyloxy]benzoate (S)-2-octyl ester |
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