In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 13 | Yes |
Popular Name: 2-oxo-2,3-dihydro-1,3-benzoxazole-6-carboxylic acid 2-oxo-2,3-dihydro-1,3-benzoxazol…
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CAS Numbers: 54903-16-1 , [54903-16-1]
2-oxo-2,3-dihydro-1,3-benzoxazole-6-carboxylicacid
2-Oxo-2,3-dihydrobenzo[d]oxazole-6-carboxylic acid
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) | 1.06 | 1.62 | -46.02 | 1 | 5 | -1 | 86 | 178.123 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 307 - 309 | Enamine Building Blocks |
MP | 307...309 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
melting_point | > 340 | KeyOrganics |
MP | >340° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |