| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 7th, 2006 | 8 | Yes |
Popular Name: p-Phenylenediamine p-Phenylenediamine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 106-50-3 , 16245-77-5 , 3114-70-3 , 50994-40-6 , 541-69-5 , 624-18-0 , [106-50-3] , [16245-77-5] , [624-18-0]
"p-Phenylenediamine dihydrochloride, 99%"
1,4-Benzenediamine; 106-50-3; C19499; para-Phenylenediamine
1,4-Diaminobenzene dihydrochloride
1,4-PhenylenediaMine Dihydrochloride
1,4-Phenylenediamine dihydrochloride; >99%
1,4-Phenylenediammonium dichloride
4-aminoaniline; 4-aminobenzylamine; CPD-10835; p-phenylenediamine
4-Dimethylaminoaniline hydrochloride; LS-105872; p-Phenylenediamine, monohydrochloride
Benzene-1,4-diamine dihydrochloride
p-Phenylenediamine dihydrochloride
p-Phenylenediamine dihydrochloride, 99%
p-Phenylenediamine dihydrochloride, 99+%
| 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) | 0.09 | 0.24 | -3.12 | 4 | 2 | 0 | 52 | 108.144 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 138-142? | Alfa-Aesar |
| Melting_Point | 138-142° | Alfa-Aesar |
| Mp [°C] | 139 - 141 | Acros Organics |
| MP | 142 | TCI |
| MP | 142 - 144 | Enamine Building Blocks |
| MP | 142...144 | Enamine Building Blocks |
| MP | 23 - 25 | Enamine Building Blocks |
| Boiling_Point | 267-271? | Alfa-Aesar |
| Boiling_Point | 267-271° | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Melting_Point | >300? | Alfa-Aesar |
| Melting_Point | >300° | Alfa-Aesar |
| UniProt Database Links | AGO2_HUMAN; DUR3_ARATH; PPD_RAPSA | ChEBI |
| Melting_Point | ca 265? | Alfa-Aesar |
| Melting_Point | ca 265° | Alfa-Aesar |
| Patent Database Links | EP0962452; EP0974576; EP1164418; EP1197799; EP1422218; EP1514905; EP1584620; EP1669107; EP1698625; EP1752451; EP1760072; EP1779837; EP1968131; GB2194945; GB2224518; US2001004779; US2001031873; US2002006898; US2002100127; US2002102224; US2002144357; US2002 | ChEBI |
| H phrase | H331: Toxic if inhaled | Acros Organics |
| H phrase | H331: Toxic if inhaled; H311: Toxic in contact with skin; H410: Very toxic to aquatic life with long lasting effects; H317: May cause an allergic skin reaction; H301: Toxic if swallowed; H319: Causes serious eye irritation | Acros Organics |
| H phrase | H410: Very toxic to aquatic life with long lasting effects | Acros Organics |
| H phrase | H410: Very toxic to aquatic life with long lasting effects; H311: Toxic in contact with skin; H317: May cause an allergic skin reaction; H331: Toxic if inhaled; H319: Causes serious eye irritation; H301: Toxic if swallowed | 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; P312: Call a POISON CENTER or doctor/physician if you feel unwell; P302 + P350: IF ON SKIN: Gently wash with plenty of soap and water; P304 + P340: IF INHALED: Remove victim | Acros Organics |
| P phrase | P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician | Acros Organics |
| P phrase | P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; P280: Wear protective gloves/protective clothing/eye protection/face protection; P312: Call a POISON CENTER or doctor/physician if you feel unwell; P302 + P350: IF ON SKIN: G | Acros Organics |
| R phrase | R23/24/25: Toxic by inhalation, in contact with skin and if swallowed. | Acros Organics |
| R phrase | R23/24/25: Toxic by inhalation, in contact with skin and if swallowed.; R36: Irritating to eyes.; R43: May cause sensitisation by skin contact.; R50/53: Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. | Acros Organics |
| S phrase | S28A: After contact with skin, wash immediately with plenty of water. | Acros Organics |
| S phrase | S28A: After contact with skin, wash immediately with plenty of water.; S36/37: Wear suitable protective clothing and gloves.; S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible).; S60: This mater | Acros Organics |
| Hazard | T: Toxic | Acros Organics |
| Hazard | T: Toxic; N: Dangerous for the environment | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.