(R)-3-Phenylbutyric acid
ALDRICH/78239 - ≥98.5% (sum of enantiomers, GC)
Synonym: (R)-β-Methylhydrocinnamic acid
CAS Number: 772-14-5
Empirical Formula (Hill Notation): C10H12O2
Molecular Weight: 164.20
MDL Number: MFCD00077841
Linear Formula: C10H12O2
Product Type: Chemical
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 78239-1ML.
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 78239-5ML.
| assay | ≥98.5% (sum of enantiomers, GC) |
| bp | 94-95 °C/0.3 mmHg (lit.) |
| density | 1.069 g/mL at 20 °C (lit.) |
| form | liquid |
| functional group | carboxylic acid |
| phenyl | |
| InChI | 1S/C10H12O2/c1-8(7-10(11) |
| InChI key | ZZEWMYILWXCRHZ-MRVPVSSYSA |
| optical activity | [α]20/D −57±2°, c = 1% in benzene |
| Quality Level | 200  |
| refractive index | n |
| SMILES string | C[C@H](CC(O)=O)c1ccccc1 |
| Other Notes: | Chiral standard. Chiral building block for the synthesis of the corresponding alcohol, amide and olefin; Stereoselective α-amination via Evans′ imide enolate |
| Packaging: | 1, 5 mL in glass bottle |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| Flash Point(F) | Not applicable |
| Flash Point(C) | Not applicable |
| Purity | ≥98.5% (sum of enantiomers, GC) |
| bp | 94-95 °C/0.3 mmHg (lit.) |
| Density | 1.069 g/mL at 20 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352002 |