CAS 130506-22-8 | 2H-1-Benzopyran-2-one, 6-nitroso- | CAS Number 130506-22-8

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130506-22-8 | 2H-1-Benzopyran-2-one, 6-nitroso-

CAS No: 130506-22-8 Catalog No: AG000UIW MDL No:

Product Description

Catalog Number:

AG000UIW

Chemical Name:

2H-1-Benzopyran-2-one, 6-nitroso-

CAS Number:

130506-22-8

Molecular Formula:

C9H5NO3

Molecular Weight:

175.1409

IUPAC Name:

6-nitrosochromen-2-one

InChI:

InChI=1S/C9H5NO3/c11-9-4-1-6-5-7(10-12)2-3-8(6)13-9/h1-5H

InChI Key:

HXTDAUGEZTYMGP-UHFFFAOYSA-N

SMILES:

O=Nc1ccc2c(c1)ccc(=O)o2

Properties

Complexity:

262

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

175.027g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

175.143g/mol

Monoisotopic Mass:

175.027g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8

Literature

Title	Journal
Rapid and flexible biochemical assays for evaluating 4'-phosphopantetheinyl transferase activity.	The Biochemical journal 20110615
Genetic mapping of targets mediating differential chemical phenotypes in Plasmodium falciparum.	Nature chemical biology 20091001
Sustained ER Ca2+ depletion suppresses protein synthesis and induces activation-enhanced cell death in mast cells.	The Journal of biological chemistry 20020419
Inhibition of HIV-1 infectivity by zinc-ejecting aromatic C-nitroso compounds.	Nature 19930204