In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 18 | No |
Popular Name: 1-Phenyldodecane 1-Phenyldodecane
Find On: PubMed — Wikipedia — Google
CAS Numbers: 123-01-3 , 85536-14-7
Dodecylbenzene sulfonic acid, mixture of C10-C13 isomers
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) | 7.84 | 13.74 | -1.47 | 0 | 0 | 0 | 0 | 246.438 | 11 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 10 | Acros Organics |
Melting_Point | 3? | Alfa-Aesar |
Melting_Point | 3° | Alfa-Aesar |
Mp [°C] | 7 | Acros Organics |
Melting_Point | 7? | Alfa-Aesar |
Melting_Point | 7° | Alfa-Aesar |
Boiling_Point | 179-180?/13mm | Alfa-Aesar |
Boiling_Point | 179-180°/13mm | Alfa-Aesar |
BP [°C] | 288 - 300 | Acros Organics |
BP [°C] | 315 | Acros Organics |
Boiling_Point | 331? | Alfa-Aesar |
Boiling_Point | 331° | Alfa-Aesar |
Hazard | C: Corrosive | Acros Organics |
H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
H phrase | H314: Causes severe skin burns and eye damage; H302: Harmful if swallowed; H412: Harmful to aquatic life with long lasting effects | Acros Organics |
P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
P phrase | P301+ P330 + P331: IF SWALLOWED: Rinse mouth. Do NOT induce vomiting; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, | Acros Organics |
R phrase | R22: Harmful if swallowed. | Acros Organics |
R phrase | R22: Harmful if swallowed.; R34: Causes burns. | Acros Organics |
S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |