NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2,3,5,6-tetrachloro-4-(2,4,5-trichlorophenyl)phenol
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IUPAC Traditional name
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Synonyms
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2,2',3,4',5,5',6-Heptachloro-[1,1'-Biphenyl]-4-ol
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2,2',3,4',5,5',6-Heptachloro-4-biphenyl-ol
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4-Hydroxy-PCB 187
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4-Hydroxy-2,2',3,4',5,5',6-heptachlorobiphenyl
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CAS Number
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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5.3126993
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H Acceptors
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1
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H Donor
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1
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LogD (pH = 5.5)
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7.146363
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LogD (pH = 7.4)
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5.771646
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Log P
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7.5452185
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Molar Refractivity
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86.8087 cm3
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Polarizability
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35.361 Å3
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Polar Surface Area
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20.23 Å2
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Rotatable Bonds
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0
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Lipinski's Rule of Five
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false
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PROPERTIES
PROPERTIES
Safety Information
Product Information
Bioassay(PubChem)
DETAILS
DETAILS
TRC
Toronto Research Chemicals -
H942790
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It was selected as a major hydroxylated polychlorinated biphenyl metabolite detected from serum of wildlife and humans and was examined for its effect on the level of serum thyroid hormone in mice. |
REFERENCES
REFERENCES
From Suppliers
Google Scholar
PubMed
Google Books
- • Barter, R., et al.: Toxicol. Appl. Pharmacol., 128, 9 (1994)
- • Hallgren, S., et al.: Arch. Toxicol., 75, 200 (1994)
- • Craft, E., et al.: Toxicol. Sci., 68, 372 (1994)
- • Kato, Y., et al.: Toxicol. Sci., 81, 309 (1994)
- • Kato, Y., et al.: Drug Metab. Dispos., 3
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PATENTS
PATENTS
PubChem Patent
Google Patent