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methyl 5-(3,4-dimethylphenoxymethyl)furan-2-carboxylate

methyl 5-(3,4-dimethylphenoxymethyl)furan-2-carboxylate

CAS: 402614-64-6

Formula: C15H16O4

SMILES: COC(=O)C1=CC=C(COC2=CC=C(C)C(C)=C2)O1

IUPAC: methyl 5-[(3,4-dimethylphenoxy)methyl]furan-2-carboxylate

InChI: InChI=1S/C15H16O4/c1-10-4-5-12(8-11(10)2)18-9-13-6-7-14(19-13)15(16)17-3/h4-8H,9H2,1-3H3

Composition: C (69.22%), H (6.20%), O (24.59%)

Molar Mass: 260.289

Atom Count: 35

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 260.104858995
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey JRNBHTDRKXZYAC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.51
Topological Polar Surface Area 48.67
Polarizability 27.27
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 402614-64-6 $65.00$65.00
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