| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 8 | No |
Popular Name: (2S)-2-amino-2-methyl-3-sulfanylpropanoic acid hydrochloride (2S)-2-amino-2-methyl-3-sulfanyl…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 148766-37-4 , 151062-55-4 , 239101-34-9 , [151062-55-4]
(2S)-2-amino-2-methyl-3-sulfanylpropanoic acid
(R)-2-Methylcysteine hydrochloride
(S)-2-Methylcysteine hydrochloride
2-Methyl-d-cysteine hydrochloride
2-Methyl-L-cysteine hydrochloride, 98%, 98% ee
D-Cysteine, 2-methyl-,hydrochloride (1:1)
| 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) | -2.26 | -0.03 | -32.58 | 3 | 3 | 0 | 68 | 135.188 | 2 | ↓ |
| Hi High (pH 8-9.5) | -2.26 | 0.51 | -51.01 | 3 | 3 | -1 | 68 | 134.18 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 120 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory 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 wate | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.