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4262-10-6

4262-10-6 | 5-Nitro-2-Phenylsulfanylpyridine

CAS No: 4262-10-6 Catalog No: AG00JKGP MDL No:MFCD00847288

Product Description

Catalog Number:
AG00JKGP
Chemical Name:
5-Nitro-2-Phenylsulfanylpyridine
CAS Number:
4262-10-6
Molecular Formula:
C11H8N2O2S
Molecular Weight:
232.2584
MDL Number:
MFCD00847288
IUPAC Name:
5-nitro-2-phenylsulfanylpyridine
InChI:
InChI=1S/C11H8N2O2S/c14-13(15)9-6-7-11(12-8-9)16-10-4-2-1-3-5-10/h1-8H
InChI Key:
DZMDLSOFHNYXMM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(nc1)Sc1ccccc1

Properties

Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.031g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.257g/mol
Monoisotopic Mass:
232.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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

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