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Phenols

Hydroquinone

对苯二酚

PHY-NP-15738 · Natural product research catalog

Catalog numberPHY-NP-15738
CAS number123-31-9
Molecular formulaC6H6O2
Molecular weight110.112 g/mol
Chemical classPhenols
Main reported sourceArctostaphylos uva-ursi
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Hydroquinone

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Product information

Hydroquinone is listed in the Phenols section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC namebenzene-1,4-diol
SMILESC1=CC(=CC=C1O)O
InChIKeyQIGBRXMKCJKVMJ-UHFFFAOYSA-N
Subclass / scaffold酚羟基×2
PubChem CID785

Computed properties

Exact mass (Da)110.0368Predicted LogP1.0978
Predicted TPSA (Ų)40.46H-bond donors2
H-bond acceptors2Rotatable bonds0

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification
Ring count1
Aromatic rings1
Fraction Csp³0.0
Synthetic accessibility score1.53
QED score0.491
Lipinski rule violations0
NPClassifier pathwayShikimates and Phenylpropanoids
Parent SMILESOc1ccc(O)cc1
Parent formulaC6H6O2
Parent molecular weight110.112
Specified stereocenters0
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceArctostaphylos uva-ursi
Reported source familiesRutaceae; Fabaceae; Asteraceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references
LOTUS / Wikidata speciesArctostaphylos uva-ursi[4]; Murraya euchrestifolia[4]; Rhodiola sacra[3]; Vernonanthura montevidensis[3]; Citrus grandis[2]; pomelo[2]; Achillea millefolium[1]; Adina trichotoma[1]; Aesculus californica[1]; Afraegle paniculata[1]; Agaricus hondensis[1]; Antennaria microphylla[1]; Arctostaphylos columbiana[1]; Brassica oleracea[1]; Bulbophyllum wendlandianum[1]
All reported source familiesRutaceae[9]; Fabaceae[9]; Asteraceae[5]; Orchid[5]; Rosaceae[3]; Lamiaceae[3]
Genus / family recordsDysidea[1]
LOTUS species records52
LOTUS reference records52
COCONUT occurrence recordsAcanthopanax ricinifolius; Achillea millefolium; Adina trichotoma; Aesculus californica; Afraegle paniculata; Agaricus hondensis; Agaricus xanthodermus; Agathosma serpyllacea; Ailanthus excelsa; Alangium premnifolium; Albizia julibrissin; Anacardium occidentale; Anchusa officinalis; Angelica tarokoensis; Antennaria microphylla; Arbutus unedo; Arctostaphylos columbiana; Arctostaphylos sp.; Arctostaphylos uva-ursi; Arctostaphylos uve-ursi (L.) Spreng.; Arisaema decipiens; Axinella vaceleti; Bombax ceiba; Botryllus tuberatus; Bragantia wallichii; Brassica oleracea; Bulbophyllum wendlandianum; Calocera viscosa; Caryopteris mongholica; Centaurea phyllocephala
COCONUT organism records166
COCONUT identifierCNP0246516.0

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

Request applicable documentation and handling information before ordering or use.