In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 11th, 2011 | 20 | No |
Popular Name: 3-(1-Adamantyl)-2-hydroxy-5-methylbenzaldehyde 3-(1-Adamantyl)-2-hydroxy-5-meth…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 231963-91-0
ADAMANTYLHYDROXYMETHYLBENZALDEHYD
benzaldehyde, 2-hydroxy-5-methyl-3-tricyclo[3.3.1.1~3,7~]dec-1-yl-
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) | 4.72 | 7.88 | -5.93 | 1 | 2 | 0 | 37 | 270.372 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 151-152° | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.