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ethyl 2-(2,3,6-trimethylphenoxy)acetate

ethyl 2-(2,3,6-trimethylphenoxy)acetate

Formula: C13H18O3

SMILES: CCOC(=O)COC1=C(C)C=CC(C)=C1C

IUPAC: ethyl 2-(2,3,6-trimethylphenoxy)acetate

InChI: InChI=1S/C13H18O3/c1-5-15-12(14)8-16-13-10(3)7-6-9(2)11(13)4/h6-7H,5,8H2,1-4H3

Composition: C (70.24%), H (8.16%), O (21.59%)

Molar Mass: 222.284

Atom Count: 34

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 222.12559444
Formal Charge 0
FSP3 0.46
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey XDLUESKRNMLVFL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.25
Topological Polar Surface Area 35.53
Polarizability 24.43
Ring Count 1
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H18O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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