Fraxinol

CAT: 0607-BA7268-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0607-BA7268-5Size:5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

486-28-2

Form

A solid

Molecular Formula

C11H10O5

Molecular Weight

222.19

Shipping Conditions

Blue ice

Storage Conditions

4°C, desiccated and protect from light.

Chemical Information

Fraxinol

Fraxinol is a hydroxycoumarin.

CAS Number	486-28-2
PubChem CID	3047739
IUPAC Name	6-hydroxy-5,7-dimethoxychromen-2-one
Molecular Formula	C11H10O5
Molecular Weight	222.19
XLogP	1.5
Topological Polar Surface Area	65
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	301

SMILES

COC1=C(C(=C2C=CC(=O)OC2=C1)OC)O

InChI

InChI=1S/C11H10O5/c1-14-8-5-7-6(3-4-9(12)16-7)11(15-2)10(8)13/h3-5,13H,1-2H3

InChIKey

PBPNOAHYDPHKFH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 486-28-2

CID: 3047739

Formula: C11H10O5

MW: 222.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	222.19
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	222.05282342
Monoisotopic Mass	222.05282342
Topological Polar Surface Area	65 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	301
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
N1957-20	Fraxin (Fraxoside; Paviin)

Catalog	Name
TBZ2341	Fraxinol
HY-N2372R	Fraxinol (Standard)