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2,6-Dimethoxybenzyl methyl ether

CAT: 1596-AR-B06616-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-B06616-01Size:10 Units
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CAS Number
16929-73-0
Molecular Formula
C10H14O3
Molecular Weight
182.22
API Name
Benzoic acid

Chemical Information

1,3-Dimethoxy-2-(methoxymethyl)benzene
CAS Number16929-73-0
PubChem CID86183606
IUPAC Name1,3-dimethoxy-2-(methoxymethyl)benzene
Molecular FormulaC10H14O3
Molecular Weight182.22
XLogP2.2
Topological Polar Surface Area27.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity126
SMILES
COCC1=C(C=CC=C1OC)OC
InChI
InChI=1S/C10H14O3/c1-11-7-8-9(12-2)5-4-6-10(8)13-3/h4-6H,7H2,1-3H3
InChIKey
LMEGMPADJPPFMN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,3-Dimethoxy-2-(methoxymethyl)benzene
CAS: 16929-73-0
CID: 86183606
Formula: C10H14O3
MW: 182.22
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight182.22
XLogP32.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass182.094294304
Monoisotopic Mass182.094294304
Topological Polar Surface Area27.7 Ų
Heavy Atom Count13
Formal Charge0
Complexity126
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