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2,3-Dimethoxyphenol

CAT: 0572-TRC-D480988-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D480988-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5150-42-5
Synonyms
1-Hydroxy-2,3-dimethoxybenzene; NSC 80659
Hazard Statement
Causes serious eye irritation.
Purity
>95% (HPLC)
Smiles
COc1cccc(O)c1OC
Molecular Formula
C8H10O3
Molecular Weight
154.16
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

2,3-Dimethoxyphenol

2,3-dimethoxyphenol is a member of phenols and a member of methoxybenzenes.

CAS Number5150-42-5
PubChem CID78828
IUPAC Name2,3-dimethoxyphenol
Molecular FormulaC8H10O3
Molecular Weight154.16
XLogP1.2
Topological Polar Surface Area38.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity116
SMILES
COC1=CC=CC(=C1OC)O
InChI
InChI=1S/C8H10O3/c1-10-7-5-3-4-6(9)8(7)11-2/h3-5,9H,1-2H3
InChIKey
QSZCGGBDNYTQHH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,3-Dimethoxyphenol
CAS: 5150-42-5
CID: 78828
Formula: C8H10O3
MW: 154.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight154.16
XLogP31.2
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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