methyl 4-(furan-2-yl)-2-hydroxy-4-oxobut-2-enoate

methyl 4-(furan-2-yl)-2-hydroxy-4-oxobut-2-enoate

CAS: 374063-90-8

Formula: C9H8O5

SMILES: COC(=O)C(O)=CC(=O)C1=CC=CO1

IUPAC: methyl 4-(furan-2-yl)-2-hydroxy-4-oxobut-2-enoate

InChI: InChI=1S/C9H8O5/c1-13-9(12)7(11)5-6(10)8-3-2-4-14-8/h2-5,11H,1H3

Composition: C (55.11%), H (4.11%), O (40.78%)

Molar Mass: 196.158

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.037173358
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZUXWAJGYRUSISS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.55
Topological Polar Surface Area	76.74
Polarizability	17.74
Ring Count	1
Rotatable Bond Count	4

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