| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 10 | Yes |
Popular Name: N-(4-chlorobenzyl)-N-methylamine N-(4-chlorobenzyl)-N-methylamine
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 104-11-0 , 65542-24-7 , 945-51-7 , [104-11-0]
(4-Chloro-benzyl)-methyl-amine
1-(4-chlorophenyl)-N-methylmethanamine
1-(4-Chlorophenyl)-N-methylmethanamine hydrochloride
4-Chloro-N-methylbenzylamine, 95%
benzenemethanamine, 4-chloro-N-methyl-
N-Methyl-4-chlorobenzylaMine hydrochloride
| 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) | 2.17 | -0.23 | -41.83 | 2 | 1 | 1 | 17 | 156.636 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.36 | 10.14 | -6.06 | 0 | 2 | 0 | 20 | 279.811 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 120-123°/15 Torr | Matrix Scientific |
| MP | 172 - 174 | Enamine Building Blocks |
| MP | 172...174 | Enamine Building Blocks |
| BP [°C] | 77 - 78 (p=1 torr) | Acros Organics |
| BP | 77 °C | Matrix Scientific |
| Boiling_Point | 77-78?/1mm | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage; H318: Causes serious eye damage | Acros Organics |
| Warnings | IRRITANT | 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 | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful 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 |
| Hazard | XN: Harmful | Acros Organics |
| Hazard | XN: Harmful; C: Corrosive | Acros Organics |
