Pyromeconic Acid O-Methyl Ether

CAT: 0024-sc-476893Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-476893Size:250 mg

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CAS Number

1193-64-2

Chemical Information

3-Methoxypyran-4-one

CAS Number	1193-64-2
PubChem CID	22645226
IUPAC Name	3-methoxypyran-4-one
Molecular Formula	C6H6O3
Molecular Weight	126.11
XLogP	0.3
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	179

SMILES

COC1=COC=CC1=O

InChI

InChI=1S/C6H6O3/c1-8-6-4-9-3-2-5(6)7/h2-4H,1H3

InChIKey

WLONNGPPUOEELX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1193-64-2

CID: 22645226

Formula: C6H6O3

MW: 126.11

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	126.11
XLogP3	0.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	126.031694049
Monoisotopic Mass	126.031694049
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	179
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
sc-483542	O-Methyl Ether Olmesartan Acid
sc-476745	Pyromeconic Acid
sc-475915	N-Trityl O-Methyl Ether Olmesartan Acid
sc-475917	N-Trityl O-Methyl Ether Olmesartan Acid Ethyl Ester
sc-472677	Salicylic Acid Methyl Ether-d3
sc-496927	Decyl Methyl Ether
sc-233992	Benzyl methyl ether
sc-235842	Methyl propargyl ether
sc-476744	Ractopamine Methyl Ether
sc-252651A	Cyclopentyl methyl ether

Catalog	Name
TRC-P997605-2.5G	Pyromeconic Acid O-Methyl Ether
166091	Pyromeconic Acid O-Methyl Ether-d3
165698	O-Methyl Ether Olmesartan Acid
165485	N-Trityl O-Methyl Ether Olmesartan Acid
TN8811-01	Volvalerenic acid A methyl ether
165486	N-Trityl O-Methyl Ether Olmesartan Acid Ethyl Ester
465833-01	Salicylic Acid Methyl Ether-d3
503232	5-CHOLENIC ACID-3β-OL METHYL ETHER
OR1028688-01	Poly (Methyl Vinyl Ether-Alt-Maleic Acid)
505328	5-CHOLENIC ACID-3β-OL METHYL ESTER, 3-METHYL ETHER