2-Cyclohexylmandelic acid
Synonym(s):α-Cyclohexylmandelic acid;2-Cyclohexyl-2-hydroxy-2-phenylacetic acid;Phenylcyclohexylglycolic acid
- CAS NO.：4335-77-7
- Empirical Formula: C14H18O3
- Molecular Weight: 234.29
- MDL number: MFCD00194543
- EINECS: 224-380-4
- SAFETY DATA SHEET (SDS)
- Update Date: 2026-01-13 11:26:40
What is 2-Cyclohexylmandelic acid?
Description
This indole alkaloid occurs in the leaves of Lespedeza bicolor var. japonica and, when pure, is a colourless oil. Its MeOH solution, the ultraviolet spectrum exhibits absorption maxima at 223.4, 279 and 291 mJi. The crystalline hydrochloride has m.p. 163-4°C (dec.); the picrate forms long, yellow needles from MeOH, m.p. 160-2°C (dec.) and the styphnate, also yellow needles, has m.p. 170°C (dec.). The structure has been established as 3-(dimethylaminoethyl)-1-methoxyindole.
Chemical properties
White Solid
The Uses of 2-Cyclohexylmandelic acid
An intermediate in the synthesis of oxybutynin (O868525).
The Uses of 2-Cyclohexylmandelic acid
intermediate for Oxybutynin HCl, Oxyphenonium Bromide
The Uses of 2-Cyclohexylmandelic acid
An intermediate in the synthesis of oxybutynin (O868525). Oxybutynin USP Related Compound A.
Definition
ChEBI: Alpha-Cyclohexylmandelic acid is a member of benzenes.
References
Morimoto, Oshio., Annalen, 682, 212 (1965)
Properties of 2-Cyclohexylmandelic acid
| Melting point: | 163 °C |
| Boiling point: | 135℃/3mm |
| Density | 1.206±0.06 g/cm3(Predicted) |
| RTECS | GV2770000 |
| storage temp. | -20°C Freezer |
| solubility | Chloroform (Slightly), Methanol (Sparingly) |
| form | Solid |
| pka | 3.49±0.25(Predicted) |
| color | White to pale brown |
| CAS DataBase Reference | 4335-77-7(CAS DataBase Reference) |
Safety information for 2-Cyclohexylmandelic acid
| Signal word | Danger |
| Pictogram(s) |
 Corrosion Corrosives GHS05  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H318:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
Computed Descriptors for 2-Cyclohexylmandelic acid
New Products
Cyclopentane-1,2-dione 2,6-Dibromoaniline (RS)-beta-Amino-beta-(4-bromophenyl)propionic acid 1-AMino-cyclobutaneMethanol HCl TETRABUTYLAMMONIUM CYANIDE 3-Amino-3-(3-fluorophenyl)propanoic acid 3-Amino-3-(4-methylphenyl)propionic acid 3-AMINO-3-(3-CHLORO-PHENYL)-PROPIONIC ACID Cefuroxime EP Impurity-A N-Nitroso hydroxy Cetrizine EP Impurity-A Noradrenaline EP Impurity D/Noradrenaline Methyl Ether Cetirizine EP Impurity A/Cetirizine CBHP Impurity Lantanoprost rc B Clidinium Bromide Impurity 4 - fluoro- 2 - methoxy- 5 - nitroaniline 1-(2-amino-5-hydroxy phenyl)propan-1-one tert-butyl 4-(6-((7-cyclo pentyl -6-(dimethyl carbamoyl) -7H-pyrrolo [2,3-d]pyrimidin-2-yl) amino)pyridin-3-yl) piperazine-1-carboxylate 2-amino-5-nitrobenzonitrile (4-Fluoro-2-methoxy-5-nitro- phenyl)-[4- (1-methyl-1H- indol-3- yl)-pyrimidin-2-yl]- amine (3R,4R)-1-benzyl-N,4-dimethylpiperidin-3- amine 2-Chloro Benzylcyanide 3,4 Diethoxy Benzylcyanide 3,4 Dimethoxy Benzylcyanide 3-chlorobenzyl cyanideRelated products of tetrahydrofuran
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