4-formyl-2-methoxyphenyl furan-2-carboxylate

4-formyl-2-methoxyphenyl furan-2-carboxylate

CAS: 326006-77-3

Formula: C13H10O5

SMILES: COC1=C(OC(=O)C2=CC=CO2)C=CC(C=O)=C1

IUPAC: 4-formyl-2-methoxyphenyl furan-2-carboxylate

InChI: InChI=1S/C13H10O5/c1-16-12-7-9(8-14)4-5-10(12)18-13(15)11-3-2-6-17-11/h2-8H,1H3

Composition: C (63.42%), H (4.09%), O (32.49%)

Molar Mass: 246.218

Atom Count: 28

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	246.052823422
Formal Charge	0
FSP3	0.08
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	KSOOHBRTOATAMA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.3
Topological Polar Surface Area	65.74
Polarizability	23.83
Ring Count	2
Rotatable Bond Count	5

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