| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 15 | No |
Popular Name: Methyl 3-isocyanato-3-phenylpropanoate Methyl 3-isocyanato-3-phenylprop…
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CAS Numbers: , 51031-37-9
METHYL 3-ISOCYANATO-3-PHENYLPROPIONATE
Methyl-3-isocyanato-3-phenylpropionate
methyl3-isocyanato-3-phenylpropanoate
| 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) | 1.48 | 4.03 | -6.92 | 0 | 4 | 0 | 56 | 205.213 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 152-153°/12 Torr | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
