Strontium Ranelate Impurity 11

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CAS Number

4371-20-4

Synonyms

[1,1'-biphenyl]-2,2',4,4',6,6'-hexaol

Molecular Formula

C12H10O6

Molecular Weight

250.21

API Name

Ranelic acid

Chemical Information

(1,1'-Biphenyl)-2,2',4,4',6,6'-hexol

difucol has been reported in Himanthalia elongata, Analipus japonicus, and other organisms with data available.

CAS Number	4371-20-4
PubChem CID	433697
IUPAC Name	2-(2,4,6-trihydroxyphenyl)benzene-1,3,5-triol
Molecular Formula	C12H10O6
Molecular Weight	250.20
XLogP	1.4
Topological Polar Surface Area	121
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Heavy Atom Count	18
Formal Charge	0
Complexity	234

SMILES

C1=C(C=C(C(=C1O)C2=C(C=C(C=C2O)O)O)O)O

InChI

InChI=1S/C12H10O6/c13-5-1-7(15)11(8(16)2-5)12-9(17)3-6(14)4-10(12)18/h1-4,13-18H

InChIKey

PHDPNHJFOMABOA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4371-20-4

CID: 433697

Formula: C12H10O6

MW: 250.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	250.20
XLogP3	1.4
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Exact Mass	250.04773803
Monoisotopic Mass	250.04773803
Topological Polar Surface Area	121 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	234
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-R01176-01	Strontium Ranelate Impurity A
AR-R10295-01	Strontium Ranelate Impurity 6
AR-R10297-01	Strontium Ranelate Impurity 8
AR-R10304-01	Strontium Ranelate Impurity D
AR-R10301-01	Strontium Ranelate Impurity 13
AR-R10300-01	Strontium Ranelate Impurity 12
AR-R01179-01	Strontium Ranelate Impurity D
AR-R01182-01	Strontium Ranelate Impurity G
AR-R10292-01	Strontium Ranelate Impurity 1
AR-R10294-01	Strontium Ranelate Impurity 5

Catalog	Name
RM-S180101-01	Strontium Ranelate Impurity 1
RM-S180102-01	Strontium Ranelate Impurity 2
021063-01	Strontium Ranelate