AromaDb: A Database of Plant's Aroma Molecules

2-Biphenylol Details

: IUPAC Name
2-Phenylphenol
:Chemical Class
:CAS Registry Number
90-43-7
:Description

:Fragrance Type
Bitter aroma

Physical and Chemical properties

PUBCHEM ID7017
Molecular Weight (mg/mol)170.212
Molecular FormulaC12H10O
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
IUPAC Name2-Phenylphenol
Canonical SMILESOc1ccccc1c2ccccc2
PUBCHEM IUPAC INCHIKEYLLEMOWNGBBNAJR-UHFFFAOYSA-N
Solubility Level3
Vapour Pressure-3.823

Absorption and Metabolism information

XLOGP3 AANA
CACTVS TPSA20.23
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP983.106
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDANon-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionMutagen
Developmental / Reproductive ToxicityNon-Toxic
Rat Oral LD500.811711
Ocular IrritancySevere
Hepatotoxic#Prediction1
Effected Human GenesNA

Ecological Information

Aerobic Biodegradability PredictionNon-Degradable

Hazard(s) Identification

Physical hazardsnot classified
Health hazards Mild
Environmental hazardsnot classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteraction Interaction ActionsPubMed Id
1 90-43-7 AR Homo sapiens 2-phenylphenol inhibits the reaction [Dihydrotestosterone results in increased expression of AR mRNA] decreases^reaction|increases^expression 21310686
2 90-43-7 AR Homo sapiens Dihydrotestosterone inhibits the reaction [2-phenylphenol results in increased activity of AR protein] decreases^reaction|increases^activity 15064155
3 90-43-7 AR Mus musculus 2-phenylphenol results in decreased activity of AR protein decreases^activity 18294747
4 90-43-7 CAT Homo sapiens CAT protein inhibits the reaction [[2-phenylphenol metabolite co-treated with NAD co-treated with Copper] results in increased mutagenesis of HRAS gene] affects^cotreatment|decreases^reaction|increases^mutagenesis 10334203
5 90-43-7 CAT Homo sapiens CAT protein inhibits the reaction [[2-phenylphenol metabolite co-treated with NAD co-treated with Copper] results in increased mutagenesis of TP53 gene] affects^cotreatment|decreases^reaction|increases^mutagenesis 10334203
6 90-43-7 CYP1A1 Mus musculus 2-phenylphenol results in increased expression of CYP1A1 mRNA increases^expression 23665931
7 90-43-7 ESR1 Homo sapiens 2-phenylphenol binds to ESR1 protein affects^binding 12598185
8 90-43-7 ESR1 Homo sapiens 2-phenylphenol results in decreased expression of ESR1 mRNA decreases^expression 12822488
9 90-43-7 ESR1 Homo sapiens 2-phenylphenol results in increased expression of ESR1 mRNA increases^expression 12737316
10 90-43-7 ESR2 Homo sapiens 2-phenylphenol results in increased expression of ESR2 mRNA increases^expression 12737316
11 90-43-7 HRAS Homo sapiens [2-phenylphenol metabolite co-treated with NAD co-treated with Copper] results in increased mutagenesis of HRAS gene affects^cotreatment|increases^mutagenesis 10334203
12 90-43-7 HRAS Homo sapiens bathocuproine inhibits the reaction [[2-phenylphenol metabolite co-treated with NAD co-treated with Copper] results in increased mutagenesis of HRAS gene] affects^cotreatment|decreases^reaction|increases^mutagenesis 10334203
13 90-43-7 NR1I2 Homo sapiens 2-phenylphenol binds to and results in increased activity of NR1I2 protein affects^binding|increases^activity 21115097
14 90-43-7 ORM1 Mus musculus 2-phenylphenol results in increased expression of ORM1 protein increases^expression 20025956
15 90-43-7 PGR Homo sapiens 2-phenylphenol results in increased expression of PGR mRNA increases^expression 12822488
16 90-43-7 PHEX Mus musculus 2-phenylphenol results in increased expression of PHEX protein increases^expression 20025956
17 90-43-7 PTGS2 Mus musculus [2-phenylphenol binds to and results in decreased activity of PTGS2 protein] which results in decreased chemical synthesis of and results in decreased secretion of Prostaglandin D2 affects^binding|decreases^activity|decreases^chemical synthesis|decreases^secretion 26359731
18 90-43-7 TP53 Homo sapiens [2-phenylphenol metabolite co-treated with NAD co-treated with Copper] results in increased mutagenesis of TP53 gene affects^cotreatment|increases^mutagenesis 10334203
19 90-43-7 TP53 Homo sapiens bathocuproine inhibits the reaction [[2-phenylphenol metabolite co-treated with NAD co-treated with Copper] results in increased mutagenesis of TP53 gene] affects^cotreatment|decreases^reaction|increases^mutagenesis 10334203
20 90-43-7 VEGFA Mus musculus 2-phenylphenol results in increased expression of VEGFA protein increases^expression 20025956
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 90-43-7 2-Biphenylol

Compound Image


2D Structure

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