| Phytochemical Name : Phenanthrene |
| PCNDIDP0072 |
| Pubchem CID : 995 |
| Molecular formula: C14H10 |
| Canonical SMILES : C1=CC=C2C(=C1)C=CC3=CC=CC=C32 |
Synonymes : PHENANTHRENE|85-01-8|Phenanthren|Phenanthracene|Phenanthrin|Ravatite|Phenantrin|Phenanthrene, pure|Phenanthren [German]|CCRIS 1233|HSDB 2166|EINECS 201-581-5|UNII-448J8E5BST|NSC 26256|NSC-26256|Phenanthrene-13C2|448J8E5BST|DTXSID6024254|CHEBI:28851|AI3-00790|(3)HELICENE|CHEMBL46730|DTXCID904254|NSC26256|MFCD00001168|Coal tar pitch volatiles: phenanthrene|Phenanthrene 10 microg/mL in Cyclohexane|Phenanthrene 200 microg/mL in Isooctane|Phenanthrene 10 microg/mL in Acetonitrile|Phenanthrene 100 microg/mL in Acetonitrile|PHENANTHRENE (IARC)|PHENANTHRENE [IARC]|CAS-85-01-8|PEY|Fenantreno|Phenanthrene-|9-Phenanthrene|phenanthrene-ring|Phenanthrene, 98%|phenanthren, kemisk rent|Phenanthrene Zone Refined|PHENANTHRENE [MI]|9,10-Dehydrophenanthrene|bmse000560|PHENANTHRENE [HSDB]|MLS002454437|WLN: L B666J|HMS2268O22|HY-B1727|Tox21_201638|Tox21_300573|BDBM50159266|STL453632|AKOS008967330|Phenanthrene (purified by sublimation)|LS-1845|Phenanthrene, zone-refined, >=99.5%|NCGC00091177-01|NCGC00091177-02|NCGC00091177-03|NCGC00091177-04|NCGC00254398-01|NCGC00259187-01|Phenanthrene, sublimed grade, >=99.5%|AC-11346|AS-12847|CID 71309489|SMR000112025|CS-0013733|FT-0631391|FT-0633623|FT-0673667|FT-0673668|P0079|P0331|P1310|P2877|EN300-18073|Phenanthrene Zone Refined (number of passes:30)|A841054|Q422037|5-Amino-6-chloro-3-pyridinecarboxylicacidmethylester|W-104097|Z57139327|Phenanthrene, certified reference material, TraceCERT(R)|Phenanthrene, purum, for fluorescence, >=97.0% (HPLC)|Phenanthrene, analytical standard, for environmental analysis|1173018-81-9 |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.350 |
| Log Po/w (XLOGP3) : 4.460 |
| Log Po/w (WLOGP) : 3.990 |
| Log Po/w (MLOGP) : 5.170 |
| Log Po/w (SILICOS-IT) : 4.100 |
| Consensus Log Po/w : 4.010 |

