| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 9 | Yes |
Popular Name: 2,4-Dichlorophenol 2,4-Dichlorophenol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 120-83-2 , 542813-74-1 , 542813-75-2 , 6341-97-5
120-83-2; 2,4-dichlorophenol; 24-DICHLOROPHENOL
120-83-2; 2,4-Dichlorophenol; C02625
2,4-Cyclohexadien-1-one, 2,4-dichloro- (9CI)
2,4-Cyclohexadien-1-one, 4,6-dichloro- (9CI)
2,4-Dichlorophenol [for Biochemical Research]
2,4-Dichlorophenol; 24-DICHLOROPHENOL; 4,6-dichlorophenol; DCP; bmse000691
| 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) | 3.00 | 2.71 | -3.36 | 1 | 1 | 0 | 20 | 163.003 | 0 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 3.46 | -35.06 | 0 | 1 | -1 | 23 | 161.995 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 209 - 210 | Acros Organics |
| Boiling_Point | 209-210? | Alfa-Aesar |
| Boiling_Point | 209-210° | Alfa-Aesar |
| BP | 210 | TCI |
| Melting_Point | 40-44? | Alfa-Aesar |
| Melting_Point | 40-44° | Alfa-Aesar |
| Mp [°C] | 41 - 44 | Acros Organics |
| MP | 42 | TCI |
| MP | 43 | TCI |
| Purity | 95% | Fluorochem |
| Purity | 97% | APIChem |
| Patent Database Links | EP1508601; EP1980296; US2003199691 | ChEBI |
| H phrase | H311: Toxic in contact with skin | Acros Organics |
| H phrase | H311: Toxic in contact with skin; H314: Causes severe skin burns and eye damage; H411: Toxic to aquatic life with long lasting effects; H302: Harmful if swallowed | Acros Organics |
| UniProt Database Links | ODO2_DELAC; RDPA_DELAC; SDPA_DELAC; TFDA_BURSR; TFDA_CUPPJ; TFDB_CUPPJ; TFDB_DELAC | ChEBI |
| 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; P302 + P350: IF ON SKIN: Gently wash with plenty of soap and water; P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P305 + P351 + P338: IF IN EYES: Rin | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R24: Toxic in contact with skin.; R34: Causes burns.; R51/53: Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat | 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.