methyl 5-(hydroxymethyl)furan-2-carboxylate

methyl 5-(hydroxymethyl)furan-2-carboxylate

CAS: 36802-01-4

Formula: C7H8O4

SMILES: COC(=O)C1=CC=C(CO)O1

IUPAC: methyl 5-(hydroxymethyl)furan-2-carboxylate

InChI: InChI=1S/C7H8O4/c1-10-7(9)6-3-2-5(4-8)11-6/h2-3,8H,4H2,1H3

Composition: C (53.85%), H (5.16%), O (40.99%)

Molar Mass: 156.137

Atom Count: 19

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	156.042258738
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	GCVVHNKBMLQFCY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.17
Topological Polar Surface Area	59.67
Polarizability	14.2
Ring Count	1
Rotatable Bond Count	3

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