Name: Name:Acetic acid, 2-[(4-methyl-2-quinolinyl)thio]-
Brand: Angene
SKU: AG0026BT
Rating: 90 (10 reviews)

Acetic acid, 2-[(4-methyl-2-quinolinyl)thio]-

CAS No.:

17880-62-5

Catalog Number:

AG0026BT

Molecular Formula:

C12H11NO2S

Molecular Weight:

233.2862

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Product Description

Catalog Number:

AG0026BT

Chemical Name:

Acetic acid, 2-[(4-methyl-2-quinolinyl)thio]-

CAS Number:

17880-62-5

Molecular Formula:

C12H11NO2S

Molecular Weight:

233.2862

MDL Number:

MFCD00749407

IUPAC Name:

2-(4-methylquinolin-2-yl)sulfanylacetic acid

InChI:

InChI=1S/C12H11NO2S/c1-8-6-11(16-7-12(14)15)13-10-5-3-2-4-9(8)10/h2-6H,7H2,1H3,(H,14,15)

InChI Key:

LYRXFOXCAABCMR-UHFFFAOYSA-N

SMILES:

OC(=O)CSc1cc(C)c2c(n1)cccc2

Properties

Complexity:

259

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.285g/mol

Monoisotopic Mass:

233.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

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

Properties