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Mephenesin 10g

CAT: 0628-A17493-10000Size: 10000 mgDry Ice: NoHazardous: No
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CAT#:0628-A17493-10000Size:10000 mg
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CAS Number
59-47-2

Chemical Information

Mephenesin

1-(2-methylphenyl)glycerol is a glycerol ether in which a single 2-methylphenyl group is attached at position 1 of glycerol via an ether linkage. It is a glycerol ether and an aromatic ether. It is functionally related to an o-cresol.

CAS Number59-47-2
PubChem CID4059
IUPAC Name3-(2-methylphenoxy)propane-1,2-diol
Molecular FormulaC10H14O3
Molecular Weight182.22
XLogP1.4
Topological Polar Surface Area49.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity138
SMILES
CC1=CC=CC=C1OCC(CO)O
InChI
InChI=1S/C10H14O3/c1-8-4-2-3-5-10(8)13-7-9(12)6-11/h2-5,9,11-12H,6-7H2,1H3
InChIKey
JWDYCNIAQWPBHD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mephenesin
CAS: 59-47-2
CID: 4059
Formula: C10H14O3
MW: 182.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight182.22
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass182.094294304
Monoisotopic Mass182.094294304
Topological Polar Surface Area49.7 Ų
Heavy Atom Count13
Formal Charge0
Complexity138
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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