Home Nitros 2-ethylmercapto-5-nitro-pyridine

2-ethylmercapto-5-nitro-pyridine

CAS No.:
107756-05-8
Catalog Number:
AG00918I
Molecular Formula:
C7H8N2O2S
Molecular Weight:
184.2156
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Product Description
Catalog Number:
AG00918I
Chemical Name:
2-ethylmercapto-5-nitro-pyridine
CAS Number:
107756-05-8
Molecular Formula:
C7H8N2O2S
Molecular Weight:
184.2156
MDL Number:
MFCD13190434
IUPAC Name:
2-ethylsulfanyl-5-nitropyridine
InChI:
InChI=1S/C7H8N2O2S/c1-2-12-7-4-3-6(5-8-7)9(10)11/h3-5H,2H2,1H3
InChI Key:
MOPUTNNENYPAMV-UHFFFAOYSA-N
SMILES:
CCSc1ccc(cn1)[N+](=O)[O-]
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.031g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.213g/mol
Monoisotopic Mass:
184.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties