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3,4-Dimethoxyphenol

CAT: 0572-TRC-D460700-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D460700-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2033-89-8
Hazard Statement
Causes skin irritation.
Smiles
COc1ccc(O)cc1OC
Molecular Formula
C8 H10 O3
Molecular Weight
154.16
InChI
InChI=1S/C8H10O3/c1-10-7-4-3-6(9)5-8(7)11-2/h3-5,9H,1-2H3
Additionnal Information
IUPAC name: 3,4-dimethoxyphenol
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

3,4-Dimethoxyphenol

3,4-dimethoxyphenol has been reported in Camellia crassicolumna and Croton lechleri with data available.

CAS Number2033-89-8
PubChem CID16251
IUPAC Name3,4-dimethoxyphenol
Molecular FormulaC8H10O3
Molecular Weight154.16
XLogP1.7
Topological Polar Surface Area38.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity116
SMILES
COC1=C(C=C(C=C1)O)OC
InChI
InChI=1S/C8H10O3/c1-10-7-4-3-6(9)5-8(7)11-2/h3-5,9H,1-2H3
InChIKey
SMFFZOQLHYIRDA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,4-Dimethoxyphenol
CAS: 2033-89-8
CID: 16251
Formula: C8H10O3
MW: 154.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight154.16
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass154.062994177
Monoisotopic Mass154.062994177
Topological Polar Surface Area38.7 Ų
Heavy Atom Count11
Formal Charge0
Complexity116
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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