In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2009 | 18 | Yes |
Popular Name: 2-(4-Methoxy-phenyl)-decahydro-quinoxaline 2-(4-Methoxy-phenyl)-decahydro-q…
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CAS Number: 1005275-85-3
2-(4-Methoxyphenyl)decahydroquinoxaline monohydrate, cis + trans
2-(4-Methoxyphenyl)decahydroquinoxaline monohydrate, cis + trans, 95%
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) | 2.77 | 4.05 | -37.75 | 3 | 3 | 1 | 38 | 247.362 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 4.25 | -40.33 | 3 | 3 | 1 | 38 | 247.362 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Melting_Point | 104-106? | Alfa-Aesar |
Melting_Point | 104-106° | Alfa-Aesar |
Purity | 95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |