Anthracene
- SMILES
- C1=CC=C2C=C3C=CC=CC3=CC2=C1
- CAS number
- 120-12-7
- Formula
- C14 H10
- Molecular weight
- Melting point
-
- Entropy of fusion
-
|
58.3
|
ΔfusS/J K-1 mol-1
|
reference 1
|
Vapor pressure
| t/°C |
PS/Pa |
PL/Pa |
log (PL/Pa) |
method and notes |
reference |
| 25 |
2.89E-4 |
0.0659 |
-1.18 |
EPI Suite estimation |
|
| 25 |
|
0.0501 |
-1.3 |
Literature-derived value (LDV) |
1 |
| 25 |
|
0.0589 |
-1.23 |
Final adjusted value (FAV) |
1 |
Water solubility
| t/°C |
SWS/mol m-3 |
SWL/mol m-3 |
log (SWL/mol m-3) |
method and notes |
reference |
| 25 |
|
0.0135 |
-1.87 |
Literature-derived value (LDV) |
1 |
| 25 |
|
0.0115 |
-1.94 |
Final adjusted value (FAV) |
1 |
Henry's law constant
| t/°C |
H/Pa m3 mol-1 |
KAW |
log (KAW) |
method and notes |
reference |
| 25 |
|
6.31E-4 |
-3.2 |
EPI Suite estimation |
|
| 25 |
|
2.04E-3 |
-2.69 |
Literature-derived value (LDV) |
1 |
| 25 |
|
2.04E-3 |
-2.69 |
Final adjusted value (FAV) |
1 |
Octanol-water partition ratio
| t/°C |
KOW |
log (KOW) |
method and notes |
reference |
| 25 |
2.24E+4 |
4.35 |
EPI Suite estimation |
|
| 25 |
4.27E+4 |
4.63 |
Literature-derived value (LDV) |
1 |
| 25 |
3.72E+4 |
4.57 |
Final adjusted value (FAV) |
1 |
Octanol-air partition ratio
| t/°C |
KOA |
log (KOA) |
method and notes |
reference |
| 25 |
3.55E+7 |
7.55 |
EPI Suite estimation |
|
| 25 |
4.27E+7 |
7.63 |
Literature-derived value (LDV) |
1 |
| 25 |
5.01E+7 |
7.7 |
Final adjusted value (FAV) |
1 |
Half-life for degradation in air
| t/°C |
half-life/day |
method and notes |
reference |
| 25 |
0.3 |
EPI Suite estimation |
|
| 25 |
2.3 |
Suggested half-life class |
2 |
Half-life for degradation in water
| t/°C |
half-life/day |
method and notes |
reference |
| 25 |
60 |
EPI Suite estimation |
|
| 25 |
23 |
Suggested half-life class |
2 |
Half-life for degradation in soil
| t/°C |
half-life/day |
method and notes |
reference |
| 25 |
120 |
EPI Suite estimation |
|
| 25 |
230 |
Suggested half-life class |
2 |
Half-life for degradation in sediment
| t/°C |
half-life/day |
method and notes |
reference |
| 25 |
542 |
EPI Suite estimation |
|
| 25 |
710 |
Suggested half-life class |
2 |
References
- 1.
- Ma, Y.G., Lei, Y.D., Xiao, H., Wania, F., Wang, W. J. Chem. Eng. Data 2010, 55, 819-825.
- 2.
- Mackay, D., Shiu, W.Y., Ma, K., Lee, S.C. Handbook of physical-chemical properties and environmental fate for organic chemicals. Volume I. CRC Press. 2006.
