| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2005 | 13 | Yes |
Popular Name: 3-(pyrrolidin-1-ylmethyl)aniline 3-(pyrrolidin-1-ylmethyl)aniline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1185347-04-9 , 183365-31-3 , [183365-31-3]
3-(Pyrrolidin-1-ylmethyl)aniline dihydrochloride
3-Pyrrolidin-1-ylmethyl-phenylamine
benzenamine, 3-(1-pyrrolidinylmethyl)-
| 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) | 1.20 | 5.45 | -32.11 | 3 | 2 | 1 | 30 | 177.271 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 69-71° | Matrix Scientific |
| Mp [°C] | 72 - 74 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Hazard | C: Corrosive | Acros Organics |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage; H332: Harmful if inhaled; H318: Causes serious eye damage; H312: Harmful in contact with skin | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; 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 | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R34: Causes burns. | Acros Organics |
| S phrase | S22: Do not breathe dust. | Acros Organics |
| S phrase | S22: Do not breathe dust.; 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, s | Acros Organics |
