| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 8 | Yes |
Popular Name: DL-Alanine ethyl ester hydrochloride DL-Alanine ethyl ester hydrochlo…
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CAS Numbers: 1115-59-9 , 17344-99-9 , 193140-71-5 , 3082-75-5 , 30959-96-7 , 4244-84-2 , 617-27-6 , 6331-09-5 , 6331-9-5 , 9/5/6331 12:00:00 AM , [1115-59-9] , [6331-09-5]
"DL-Alanine ethyl ester hydrochloride, 98%"
(R)-Ethyl 2-amino-propionate hydrochloride
(R)-Ethyl 2-aminopropanoate hydrochloride
(R)-Ethyl 2-aminopropionate HCl
(R)-Ethyl2-aminopropanoatehydrochloride
2-Amino-3,3,3-trifluoropropionic acid ethyl ester hydrochloride
2-Amino-propanoic acid ethyl ester
3,3,3-Trifluoro-DL-alanine ethyl ester hydrochloride
3-Alanine Ethyl Ester Hydrochloride
D-Alanine ethyl ester hydrochloride
D-Alanine ethyl ester hydrochloride, 95%
D-Alanine Ethylester Hydrochloride [6331-09-5]; (H-D-Ala-OEt HCl)
D-ALANINE ETHYLESTER HYDROCHLORIDE; [6331-09-5]
D-Alanineethyl ester hydocchloride
DL-Alanine ethyl ester hydrochloride, 99%
DL-Ethyl 2-aminopropanoate hydrochloride
Ethyl 2-amino-3,3,3-trifluoropropionate hydrochloride
Ethyl 2-amino-3,3,3-trifluoropropionate hydrochloride, 96%
Ethyl 2-amino-3,3,3-trifluoropropionate hydrochloride, 97%
Ethyl 2-aminopropanoate hydrochloride
Ethyl 3-aminopropanoate hydrochloride
Ethyl D-alaninate hydrochloride
L-Alanine ethyl ester hydrochloride
L-Alanine Ethylester Hydrochloride [1115-59-9]; (H-Ala-OEt .HCl)
| 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) | -0.24 | 0.91 | -3.82 | 2 | 3 | 0 | 52 | 117.148 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 143-147? | Alfa-Aesar |
| Melting_Point | 143-147° | Alfa-Aesar |
| MP | 63.4-66.7o C | Indofine |
| MP | 78-80 °C (dec.)(lit.) | Indofine |
| MP | 78.7-82.2o C | Indofine |
| Melting_Point | 84-86? | Alfa-Aesar |
| MP | 84-86° | Oakwood Chemical |
| MP | 85 - 87 | Enamine Building Blocks |
| MP | 85...87 | Enamine Building Blocks |
| Mp [°C] | 87 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 99% | Fluorochem |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| H phrase | H335: May cause respiratory irritation; H315: Causes skin irritation; H319: Causes serious eye irritation | Acros Organics |
| 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 |
| Notes | USP, pyrogen free | Apollo Scientific Bioactives |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.