Name: Name:3-[(2-methyl-3-furoyl)amino]benzoic acid
Brand: Angene
SKU: AG00C1X8
Rating: 90 (10 reviews)

3-[(2-methyl-3-furoyl)amino]benzoic acid

CAS No.:

298686-55-2

Catalog Number:

AG00C1X8

Molecular Formula:

C13H11NO4

Molecular Weight:

245.2307

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

95%

In Stock USA

United States

$129

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Product Description

Catalog Number:

AG00C1X8

Chemical Name:

3-[(2-methyl-3-furoyl)amino]benzoic acid

CAS Number:

298686-55-2

Molecular Formula:

C13H11NO4

Molecular Weight:

245.2307

MDL Number:

MFCD01926027

IUPAC Name:

3-[(2-methylfuran-3-carbonyl)amino]benzoic acid

InChI:

InChI=1S/C13H11NO4/c1-8-11(5-6-18-8)12(15)14-10-4-2-3-9(7-10)13(16)17/h2-7H,1H3,(H,14,15)(H,16,17)

InChI Key:

ROJXTCDVXKNYKB-UHFFFAOYSA-N

SMILES:

O=C(c1ccoc1C)Nc1cccc(c1)C(=O)O

Properties

Complexity:

331

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

245.234g/mol

Monoisotopic Mass:

245.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

79.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501