In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 23 | No |
Popular Name: 3,3-bis(4-chlorobenzyl)-2,4-pentanedione 3,3-bis(4-chlorobenzyl)-2,4-pent…
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CAS Numbers: 130745-77-6 , [130745-77-6]
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) | 4.44 | 3.57 | -20.29 | 0 | 2 | 0 | 34 | 349.257 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 109 - 111 | KeyOrganics |
MP | 109-111° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |