In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 13 | Yes |
Popular Name: 2-Pyrrolidin-1-yl-benzylamine 2-Pyrrolidin-1-yl-benzylamine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1431966-79-8 , 1803610-83-4 , 72752-53-5 , [72752-53-5]
(2-(Pyrrolidin-1-yl)phenyl)methanamine
(2-pyrrolidin-1-ylphenyl)methylamine
2-(Pyrrolidin-1-yl)benzylamine
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) | 1.58 | 3.51 | -39.71 | 3 | 2 | 1 | 31 | 177.271 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 108 - 111 | Enamine Building Blocks |
MP | 108...111 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Hazard | C: Corrosive | Acros Organics |
H phrase | H318: Causes serious eye damage | Acros Organics |
H phrase | H318: Causes serious eye damage; H332: Harmful if inhaled; H312: Harmful in contact with skin; H314: Causes severe skin burns and eye damage; H302: Harmful if swallowed | 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 | S23: Do not breathe gas/fumes/vapour/spray. | Acros Organics |
S phrase | S23: Do not breathe gas/fumes/vapour/spray.; 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 | Acros Organics |