Name: Name:[1,1'-Biphenyl]-2,3',4,5',6-pentaol
Brand: Angene
SKU: AG003TQQ
Rating: 90 (10 reviews)

[1,1'-Biphenyl]-2,3',4,5',6-pentaol

CAS No.:

491-45-2

Catalog Number:

AG003TQQ

Molecular Formula:

C12H10O5

Molecular Weight:

234.2048

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Product Description

Catalog Number:

AG003TQQ

Chemical Name:

[1,1'-Biphenyl]-2,3',4,5',6-pentaol

CAS Number:

491-45-2

Molecular Formula:

C12H10O5

Molecular Weight:

234.2048

MDL Number:

MFCD01543374

IUPAC Name:

2-(3,5-dihydroxyphenyl)benzene-1,3,5-triol

InChI:

InChI=1S/C12H10O5/c13-7-1-6(2-8(14)3-7)12-10(16)4-9(15)5-11(12)17/h1-5,13-17H

InChI Key:

KICYRZIVKKYRFS-UHFFFAOYSA-N

SMILES:

Oc1cc(O)c(c(c1)O)c1cc(O)cc(c1)O

UNII:

U4GNW4D2BR

NSC Number:

65069

Properties

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.207g/mol

Monoisotopic Mass:

234.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
In silico identification and biochemical evaluation of novel inhibitors of NRH:quinone oxidoreductase 2 (NQO2).	Bioorganic & medicinal chemistry letters 20101215

Properties