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79929-21-8

79929-21-8 | 2,2'-sulfanediylbis(5-nitrothiophene)

CAS No: 79929-21-8 Catalog No: AG005EXP MDL No:

Product Description

Catalog Number:
AG005EXP
Chemical Name:
2,2'-sulfanediylbis(5-nitrothiophene)
CAS Number:
79929-21-8
Molecular Formula:
C8H4N2O4S3
Molecular Weight:
288.3234
IUPAC Name:
2-nitro-5-(5-nitrothiophen-2-yl)sulfanylthiophene
InChI:
InChI=1S/C8H4N2O4S3/c11-9(12)5-1-3-7(15-5)17-8-4-2-6(16-8)10(13)14/h1-4H
InChI Key:
LHGZKGXXVBQKNL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(s1)Sc1ccc(s1)[N+](=O)[O-]
NSC Number:
33522

Properties

Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.933g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.31g/mol
Monoisotopic Mass:
287.933g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
173A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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