| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 17 | No |
Popular Name: (2-Methoxy-5-phenyl)phenyl isothiocyanate (2-Methoxy-5-phenyl)phenyl isoth…
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CAS Numbers: 206761-68-4 , [206761-68-4]
1,1-Biphenyl, 3-isothiocyanato-4-methoxy- (9CI)
2-Methoxybiphenyl 3-isothiocyanate
2-Methoxybiphenyl 3-isothiocyanate, 97%
2-Methoxybiphenyl3-isothiocyanate
| 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) | 5.08 | 1.05 | -7.53 | 0 | 2 | 0 | 21 | 241.315 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 78-81? | Alfa-Aesar |
| Melting_Point | 78-81° | Alfa-Aesar |
| MP | 80-82° | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.