In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 8 | No |
Popular Name: 1-(2-Chloroethyl)pyrrolidine hydrochloride 1-(2-Chloroethyl)pyrrolidine hyd…
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CAS Numbers: 50-41-9 , 5050-41-9 , 7050-67-1 , 7250-67-1 , [5050-41-9] , [7250-67-1]
1-(2-Chloroethyl)pyrrolidine HCl
1-(2-Chloroethyl)pyrrolidine hydrochloride, 98%
2-(1-Pyrrolidinyl)ethyl chloride hydrochloride
2-Chloroethylpyrrolidinehydrochloride
2-Pyrrolidinoethyl chloride hydrochloride
N-(2-Chloroethyl)pyrrolidine hydrochloride
N-(2-Chloroethyl)pyrrolidine hydrochloride, 98%
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) | 1.35 | 5.21 | -33.84 | 1 | 1 | 1 | 4 | 134.63 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 167-170° | Oakwood Chemical |
Melting_Point | 168-173? | Alfa-Aesar |
Melting_Point | 168-173° | Alfa-Aesar |
Mp [°C] | 171 - 175 | Acros Organics |
MP | 172 | TCI |
BP | 237 | TCI |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Purity | 98% | Fluorochem |
H phrase | H319: Causes serious eye irritation | Acros Organics |
H phrase | H319: Causes serious eye irritation; H335: May cause respiratory irritation; H302: Harmful if swallowed; H315: Causes skin irritation; H332: Harmful if inhaled | 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; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P304 + P340: IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing; P30 | Acros Organics |
R phrase | R20/22: Harmful by inhalation and if swallowed. | Acros Organics |
R phrase | R20/22: Harmful by inhalation and if swallowed.; 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 |
Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.