Methyl β-hydroxy-2-methoxybenzenepropanoate

CAT: 0127-OR1081469-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1081469-01Size:250 mg

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CAS Number

124393-60-8

MDL Number

MFCD34875934

Purity

95%

Smiles

C (CC (=O) OC) (O) c1c (OC) cccc1

Chemical Information

Methyl beta-hydroxy-2-methoxybenZenepropanoate

CAS Number	124393-60-8
PubChem CID	13929552
IUPAC Name	methyl 3-hydroxy-3-(2-methoxyphenyl)propanoate
Molecular Formula	C11H14O4
Molecular Weight	210.23
XLogP	0.9
Topological Polar Surface Area	55.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	15
Formal Charge	0
Complexity	205

SMILES

COC1=CC=CC=C1C(CC(=O)OC)O

InChI

InChI=1S/C11H14O4/c1-14-10-6-4-3-5-8(10)9(12)7-11(13)15-2/h3-6,9,12H,7H2,1-2H3

InChIKey

ZVPONPNVNRCQHG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 124393-60-8

CID: 13929552

Formula: C11H14O4

MW: 210.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	210.23
XLogP3	0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	210.08920892
Monoisotopic Mass	210.08920892
Topological Polar Surface Area	55.8 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	205
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

Catalog	Name
OR1098493-01	Methyl β-hydroxy-3-methoxybenzenepropanoate
OR1095099-01	1,1-Dimethylethyl β-hydroxy-3-methoxybenzenepropanoate
OR1085017-01	1,1-Dimethylethyl β-hydroxy-4-methoxybenzenepropanoate
OR1083356-01	Methyl β-hydroxy-β-methyl-2-pyridinepropanoate
OR1001720-01	Methyl 2-hydroxy-a, ?-dioxobenzenebutanoate
OR1065385-01	Methyl 2-hydroxy-2-methoxyacetate
OR914697-01	Methyl 2-hydroxy-2-phenylacetate
OR83091-01	Methyl 2-hydroxy-2-phenylpropanoate
OR1085742	Methyl 2- (hydroxy (phenyl) methyl) acrylate
OR1023689-01	Methyl2-Hydroxy-2-Methyl-3-Oxobutyrate

Catalog	Name
278778-01	2-Hydroxy methyl imidazole
RG-E141053-01	Methyl 2-hydroxy-β-oxobenzenepropanoate
sc-235684	Methyl 2-hydroxy-2-methyl-3-oxobutyrate
VAA73195-01	Methyl 2-hydroxy-2-phenylpropanoate
454964-01	Methyl 2-Hydroxy-2-methoxyacetate
sc-486876	Methyl 2-Hydroxy-2-methoxyacetate
VCA39774-01	Methyl 3-hydroxy-2-methyl-2-phenylpropanoate
TRC-M211070-5G	Methyl 2-Hydroxy-2-methylpropanoate
AR-M03337-01	Methyl 2-hydroxy-2-phenylacetate
MBS5827096	1-[[2-Hydroxy-1-(hydroxy methyl)ethoxy]methyl]cytosine