| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 20 | Yes |
Popular Name: Dibutyl phthalate Dibutyl phthalate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 84-74-2 , 93952-11-5 , [84-74-2]
Benzene-1,2-dicarboxylic acid di-n-butylester
butyl 2-(butoxycarbonyl)benzoate
dibutyl benzene-1,2-dicarboxylate
| 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) | 4.43 | 11.14 | -12.33 | 0 | 4 | 0 | 53 | 278.348 | 10 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 35 | Acros Organics |
| Melting_Point | 35? | Alfa-Aesar |
| Melting_Point | 35° | Alfa-Aesar |
| Boiling_Point | 339-340? | Alfa-Aesar |
| Boiling_Point | 339-340° | Alfa-Aesar |
| BP [°C] | 340 | Acros Organics |
| Solubility: | Chloroform, Methanol | Toronto Research Chemicals |
| UniProt Database Links | CP2A4_MOUSE; CP2A5_MOUSE; DBP10_NEUCR; DBP2_NEUCR; DBP3_NEUCR; DBP4_NEUCR; DBP5_NEUCR; DBP7_NEUCR; DBP8_NEUCR; DBP9_NEUCR; DBP_MOUSE; DDX1_HUMAN; DHB4_HUMAN; DHB4_MOUSE; DHB4_RAT; DPPA_ECOLI; HLF_MOUSE; NAC22_ARATH; NFIL3_BOVIN; NFIL3_HUMAN; NFIL3_MOUSE | ChEBI |
| H phrase | H360Df: May damage the unborn child. Suspected of damaging fertility | Acros Organics |
| P phrase | P201: Obtain special instructions before use | Acros Organics |
| Therapy | plasticiser, suspect endocrine disruptor | SMDC Pharmakon |
| R phrase | R61: May cause harm to the unborn child. | Acros Organics |
| S phrase | S53: Avoid exposure - obtain special instructions before use. | Acros Organics |
| Hazard | T: Toxic | Acros Organics |
