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Methyl 3-hydroxy-4,5-dimethoxybenzoate

CAT: 0572-TRC-M780505-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M780505-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
83011-43-2
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
COC(=O)c1cc(O)c(OC)c(OC)c1
Molecular Formula
C10H12O5
Molecular Weight
212.2
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Methyl 3-hydroxy-4,5-dimethoxybenzoate
CAS Number83011-43-2
PubChem CID2733956
IUPAC Namemethyl 3-hydroxy-4,5-dimethoxybenzoate
Molecular FormulaC10H12O5
Molecular Weight212.20
XLogP1.4
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity218
SMILES
COC1=CC(=CC(=C1OC)O)C(=O)OC
InChI
InChI=1S/C10H12O5/c1-13-8-5-6(10(12)15-3)4-7(11)9(8)14-2/h4-5,11H,1-3H3
InChIKey
LCIFXEQPXQVBGL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 3-hydroxy-4,5-dimethoxybenzoate
CAS: 83011-43-2
CID: 2733956
Formula: C10H12O5
MW: 212.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight212.20
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass212.06847348
Monoisotopic Mass212.06847348
Topological Polar Surface Area65 Ų
Heavy Atom Count15
Formal Charge0
Complexity218
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
BUP02969-01Methyl 3-hydroxy-4,5-dimethoxybenzoate
M20221-01Methyl-4-hydroxy-3,5-dimethoxybenzoate 98%
OR1032450-01Methyl 2-hydroxy-4,5-dimethoxybenzoate
GTR19237041-01Methyl 2-hydroxy-3,4-dimethoxybenzoate
FM61761-01Methyl 3,5-dimethoxybenzoate
AL BF 0534-01Methyl 2-hydroxy-4,6-dimethoxybenzoate
OR5931-01Methyl 4-bromo-3,5-dimethoxybenzoate
PC1009871-01Methyl 3-fluoro-4,5-dimethoxybenzoate
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