Ononetin 200mg

CAT: 0628-A13776-200Size: 200 mgDry Ice: NoHazardous: No

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CAT#:0628-A13776-200Size:200 mg

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CAS Number

487-49-0

Chemical Information

Ononetin

1-(2,4-Dihydroxyphenyl)-2-(4-methoxyphenyl)ethanone is a stilbenoid.

CAS Number	487-49-0
PubChem CID	259632
IUPAC Name	1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenyl)ethanone
Molecular Formula	C15H14O4
Molecular Weight	258.27
XLogP	3.2
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	19
Formal Charge	0
Complexity	297

SMILES

COC1=CC=C(C=C1)CC(=O)C2=C(C=C(C=C2)O)O

InChI

InChI=1S/C15H14O4/c1-19-12-5-2-10(3-6-12)8-14(17)13-7-4-11(16)9-15(13)18/h2-7,9,16,18H,8H2,1H3

InChIKey

XHBZOAYMBBUURD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 487-49-0

CID: 259632

Formula: C15H14O4

MW: 258.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	258.27
XLogP3	3.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	258.08920892
Monoisotopic Mass	258.08920892
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	297
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
MBS3616262-01	Ononetin
00527-20151	Welchrom Carb/NH2, 200mg/200mg/6mL, 30pcs/pk
00569-11151	Welchrom SAX/PSA, 200mg/200mg, 6mL, 30pcs/pk
00569-11132	Welchrom SAX/PSA, 200mg/200mg, 3mL, 50pcs/pk
00527-20132	Welchrom Carb/NH2, 200mg/200mg/3mL, 50pcs/pk
00548-20151	Welchrom Carb/PSA, 200mg/200mg/6mL, 30pcs/pk
00548-20132	Welchrom Carb/PSA, 200mg/200mg/3mL, 50pcs/pk
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