| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 9 | Yes |
Popular Name: 2,5-DIMETHYLANILINE 2,5-DIMETHYLANILINE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 51786-53-9 , 95-78-3
1-Amino-2,5-dimethylbenzene hydrochloride
1-AMINO-2,5-DIMETHYLBENZENEHYDROCHLORIDE
2,5-Bis(Trifluoromethyl)Aniline[328-93-8]; (a,a,a,a',a',a'-Hexafluoro-3,5-xylidine)
2,5-Dimethyl-benzenamine; 2,5-Xylidine; 95-78-3; C18993
2,5-Dimethyl-phenylamine hydrochloride
2,5-Dimethylaniline;2,5-Xylidine
2-Methyl-5-(Trifluoromethyl)Aniline [25449-96-1]; (3-Amino-4-methylbenzotrifluoride)
2-phenyl-6-[(E)-2-phenylethenyl]-4-pyranone
2-phenyl-6-[(E)-styryl]pyran-4-one
3-Amino-4-(Methylthio)Benzotrifluoride; (2-(Methylthio)-5-(trifluoromethyl)aniline)
| 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) | 2.25 | 3.81 | -2.86 | 2 | 1 | 0 | 26 | 121.183 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 104 / 15 | TCI |
| Mp [°C] | 11.5 | Acros Organics |
| MP | 11.5° | Oakwood Chemical |
| Melting_Point | 15? | Alfa-Aesar |
| Melting_Point | 15° | Alfa-Aesar |
| BP [°C] | 218 | Acros Organics |
| Boiling_Point | 218? | Alfa-Aesar |
| Boiling_Point | 218° | Alfa-Aesar |
| M.P | 34-38C | Indofine |
| ALOGPS_SOLUBILITY | 5.07e+00 g/l | DrugBank-experimental |
| Purity | 97% | APIChem |
| Purity | 99% | Fluorochem |
| H phrase | H373: May cause damage to organs through prolonged or repeated exposure | Acros Organics |
| H phrase | H373: May cause damage to organs through prolonged or repeated exposure; H330: Fatal if inhaled; H411: Toxic to aquatic life with long lasting effects; H301: Toxic if swallowed; H311: Toxic in contact with skin | Acros Organics |
| UniProt Database Links | LAC1_PYCCI | ChEBI |
| 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.; R33: Danger of cumulative effects.; R51/53: 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).; S61: Avoid rele | Acros Organics |
| Hazard | T: Toxic | Acros Organics |
| Hazard | T: Toxic; N: Dangerous for the environment | Acros Organics |
| PUBCHEM_PATENT_ID | US3950145; US4005992; US4005993; US4052171; US4082517; US4483800; US4485051; US4487722; US4611075; USRE29488 | IBM Patent Data |
