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3-[ (2-Methoxyethoxy) methoxy]benzaldehyde

CAT: 0024-sc-391852Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-391852Size:250 mg
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CAS Number
139461-72-6

Chemical Information

3-[(2-Methoxyethoxy)methoxy]benzaldehyde
CAS Number139461-72-6
PubChem CID15755175
IUPAC Name3-(2-methoxyethoxymethoxy)benzaldehyde
Molecular FormulaC11H14O4
Molecular Weight210.23
XLogP1.2
Topological Polar Surface Area44.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count15
Formal Charge0
Complexity172
SMILES
COCCOCOC1=CC=CC(=C1)C=O
InChI
InChI=1S/C11H14O4/c1-13-5-6-14-9-15-11-4-2-3-10(7-11)8-12/h2-4,7-8H,5-6,9H2,1H3
InChIKey
VBUZAHLUWZTYIQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-[(2-Methoxyethoxy)methoxy]benzaldehyde
CAS: 139461-72-6
CID: 15755175
Formula: C11H14O4
MW: 210.23
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight210.23
XLogP31.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass210.08920892
Monoisotopic Mass210.08920892
Topological Polar Surface Area44.8 Ų
Heavy Atom Count15
Formal Charge0
Complexity172
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