| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 6 | Yes |
Popular Name: 2-Amino-1,3-propanediol 2-Amino-1,3-propanediol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 24070-20-0 , 3/2/534 , 534-03-2 , 73708-65-3 , [534-03-2] , [73708-65-3]
"2-Amino-1,3-propanediol, 99%"
2-Amino-1,3-propanediol hydrochloride
2-Amino-1,3-propanediol hydrochloride, 98%
2-Amino-1,3-propanediol oxalate
2-amino-1,3-propanediol; 534-03-2; CPD-9382; serinol
2-Amino-1,3-propanediol; Serinol
2-Amino-1,3-propanediolhydrochloride
| 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) | -2.09 | -7.31 | -35.26 | 5 | 3 | 1 | 68 | 92.118 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 104-106? | Alfa-Aesar |
| Melting_Point | 104-106° | Alfa-Aesar |
| BP [°C] | 115 - 116 | Acros Organics |
| BP | 115-120°/0.06mm | Oakwood Chemical |
| BP | 116 / 1 | TCI |
| Boiling_Point | 128?/0.8mm | Alfa-Aesar |
| Boiling_Point | 128°/0.8mm | Alfa-Aesar |
| MP | 52 | TCI |
| MP | 52 - 55 | Enamine Building Blocks |
| Mp [°C] | 52 - 56 | Acros Organics |
| Melting_Point | 52-56? | Alfa-Aesar |
| Melting_Point | 52-56° | Alfa-Aesar |
| MP | 52...55 | Enamine Building Blocks |
| MP | 55-57° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Purity | 99% | Fluorochem |
| Hazard | C: Corrosive | Acros Organics |
| H phrase | H318: Causes serious eye damage | Acros Organics |
| H phrase | H318: Causes serious eye damage; H314: Causes severe skin burns and eye damage | Acros Organics |
| Warnings | IRRITANT, MOISTURE SENSITIVE | Matrix Scientific |
| Warnings | Irritant/Moisture Sensitive | Matrix Scientific |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r | Acros Organics |
| R phrase | R34: Causes burns. | 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.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.