| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | Yes |
Popular Name: 1-Benzyl-3-carbethoxy-4-piperidone hydrochloride 1-Benzyl-3-carbethoxy-4-piperido…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1454-53-1 , 1823182-44-0 , 41276-30-6 , [1454-53-1]
"1-Benzyl-4-piperidone-3-carboxylic acid ethyl ester hydrochloride hydrate, 99%"
1-Benzyl-3-carbethoxy-4-piperidone
1-Benzyl-3-carbethoxy-4-piperidone HCl
1-Benzyl-3-carbethoxy-4-piperidone hydrochloride, 97%
1-Benzyl-3-carbethoxy-4-piperidone, HCl
1-benzyl-3-carbethoxy-piperidone HCl
1-Benzyl-3-carboethoxy-4-piperidone
1-Benzyl-3-carboethoxy-4-piperidone hydrochloride
1-Benzyl-3-carboethoxy-4-piperidone hydrochloride hydrate
1-Benzyl-3-ethoxycarbonyl-4-piperidone
1-Benzyl-3-ethoxycarbonyl-4-piperidone HCl
1-Benzyl-3-ethoxycarbonyl-4-piperidone hydrochloride
1-Benzyl-3-ethoxycarbonyl-4-piperidone hydrochloride hydrate
1-Benzyl-3-ethoxycarbonyl-4-piperidone hydrochloride hydrate, 97%, ca 10% water
1-Benzyl-3-ethoxycarbonyl-4-piperidone hydrochloride, 98%+
3-piperidinecarboxylic acid, 4-oxo-1-(phenylmethyl)-, ethyl ester
3-piperidinecarboxylic acid, 4-oxo-1-(phenylmethyl)-, ethyl ester, hydrochloride
BENZYLCARBOETHOXYPIPERIDONEHYDROCHLORID
Ethyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride
Ethyl 1-Benzyl-4-oxo-3-piperidinecarboxylate Hydrochloride Hydrate
ethyl 1-benzyl-4-oxopiperidine-3-carboxylate
ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride
Ethyl 1-benzyl-4-piperidone-3-carboxylate hydrochloride hydrate
Ethyl 1-benzylpiperidin-4-one-3-carboxylate hydrochloride
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.65 | 7.32 | -7.82 | 0 | 4 | 0 | 47 | 261.321 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 160 - 170 | Acros Organics |
| MP | 161 - 163 | Enamine Building Blocks |
| MP | 161...163 | Enamine Building Blocks |
| MP | 173 - 175 | Enamine Building Blocks |
| MP | 175° | Oakwood Chemical |
| MP | 180 - 182 | Enamine Building Blocks |
| MP | 180...182 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Melting_Point | ca 170? dec. | Alfa-Aesar |
| Melting_Point | ca 170° dec. | Alfa-Aesar |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H315: Causes skin irritation; H335: May cause respiratory irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.
