| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 11 | Yes |
Popular Name: 3-chloro-4-methoxybenzylamine hydrochloride 3-chloro-4-methoxybenzylamine hy…
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CAS Numbers: 115514-77-7 , 41965-95-1 , [115514-77-7] , [41965-95-1]
(3-chloro-4-methoxyphenyl)methanamine
(3-Chloro-4-methoxyphenyl)methanamine hydrochloride
3-Chloro-4-methoxy-benzylamine
3-Chloro-4-methoxybenzenemethanamine
3-Chloro-4-methoxybenzylamine hydrochloride, 97%
3-Chloro-4-methoxybenzylamine, HCl
4-Aminomethyl-2-chloroanisole HCl
4-Aminomethyl-2-chloroanisole 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) | 1.79 | 2.38 | -49.14 | 3 | 2 | 1 | 37 | 172.635 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 2.540000000000000e+002 - 2.560000000000000e+002 | KeyOrganics |
| Melting_Point | 250-255? | Alfa-Aesar |
| melting_point | 254 - 256 | KeyOrganics |
| MP | 254-256° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 99% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.