CAS 19261-03-1 | [1,1'-Biphenyl]-2,2',3,3'-tetrol | CAS Number 19261-03-1

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19261-03-1 | [1,1'-Biphenyl]-2,2',3,3'-tetrol

CAS No: 19261-03-1 Catalog No: AG002G52 MDL No:

Product Description

Catalog Number:

AG002G52

Chemical Name:

[1,1'-Biphenyl]-2,2',3,3'-tetrol

CAS Number:

19261-03-1

Molecular Formula:

C12H10O4

Molecular Weight:

218.2054

IUPAC Name:

3-(2,3-dihydroxyphenyl)benzene-1,2-diol

InChI:

InChI=1S/C12H10O4/c13-9-5-1-3-7(11(9)15)8-4-2-6-10(14)12(8)16/h1-6,13-16H

InChI Key:

AIEZFWSIZQLXEG-UHFFFAOYSA-N

SMILES:

Oc1c(O)cccc1c1cccc(c1O)O

Properties

Complexity:

209

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

218.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

218.208g/mol

Monoisotopic Mass:

218.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
Synthesis of highly hydroxylated aromatics by evolved biphenyl dioxygenase and subsequent dihydrodiol dehydrogenase.	Applied microbiology and biotechnology 20070701
Material properties of polymerized NDGA-collagen composite fibers: development of biologically based tendon constructs.	Biomaterials 20020101
Metabolism of 2,2'-dihydroxybiphenyl by Pseudomonas sp. strain HBP1: production and consumption of 2,2',3-trihydroxybiphenyl.	Journal of bacteriology 19930301