| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2004 | 10 | No |
Popular Name: Methyl 6-oxohexanoate Methyl 6-oxohexanoate
Find On: PubMed — Wikipedia — Google
CAS Number: 6654-36-0
Adipic semialdehyde methyl ester
Adipic semialdehyde methyl ester, 95%
| 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) | 1.24 | 4.33 | -10.35 | 0 | 3 | 0 | 43 | 144.17 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 59 - 61 (p=1 torr) | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P304 + P340: IF INHALED: Remove victim to fresh air and ke | Acros Organics |
