Name: Name:2,5-Furandicarboxylic acid, 3,4-dihydroxy-, diethyl ester
Brand: Angene
SKU: AG00IB2K
Rating: 90 (10 reviews)

2,5-Furandicarboxylic acid, 3,4-dihydroxy-, diethyl ester

CAS No.:

6270-57-1

Catalog Number:

AG00IB2K

Molecular Formula:

C10H12O7

Molecular Weight:

244.1981

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Product Description

Catalog Number:

AG00IB2K

Chemical Name:

2,5-Furandicarboxylic acid, 3,4-dihydroxy-, diethyl ester

CAS Number:

6270-57-1

Molecular Formula:

C10H12O7

Molecular Weight:

244.1981

MDL Number:

MFCD00092386

IUPAC Name:

diethyl 3,4-dihydroxyfuran-2,5-dicarboxylate

InChI:

InChI=1S/C10H12O7/c1-3-15-9(13)7-5(11)6(12)8(17-7)10(14)16-4-2/h11-12H,3-4H2,1-2H3

InChI Key:

JGCMPUKYPRCPRE-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1oc(c(c1O)O)C(=O)OCC

NSC Number:

35562

Properties

Complexity:

262

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.199g/mol

Monoisotopic Mass:

244.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

106A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Pyrogallol and its analogs can antagonize bacterial quorum sensing in Vibrio harveyi.	Bioorganic & medicinal chemistry letters 20080301

Properties