Methyl 2-hydroxy-2-methoxyacetate

CAT: 0127-OR1065385-02Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR1065385-02Size:5 g

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CAS Number

19757-97-2

MDL Number

MFCD00043941

Purity

80%

Smiles

COC(O)C(=O)OC

Chemical Information

Methyl 2-Hydroxy-2-methoxyacetate

CAS Number	19757-97-2
PubChem CID	2724791
IUPAC Name	methyl 2-hydroxy-2-methoxyacetate
Molecular Formula	C4H8O4
Molecular Weight	120.10
XLogP	-0.6
Topological Polar Surface Area	55.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	8
Formal Charge	0
Complexity	80

SMILES

COC(C(=O)OC)O

InChI

InChI=1S/C4H8O4/c1-7-3(5)4(6)8-2/h3,5H,1-2H3

InChIKey

OVJJVYHDJVQFSF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19757-97-2

CID: 2724791

Formula: C4H8O4

MW: 120.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	120.10
XLogP3	-0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	120.04225873
Monoisotopic Mass	120.04225873
Topological Polar Surface Area	55.8 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	80.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
454964-01	Methyl 2-Hydroxy-2-methoxyacetate
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