Home Nitriles 3,3′-Dithiobis(propionitrile)

3,3′-Dithiobis(propionitrile)

CAS No.:
42841-31-6
Catalog Number:
AG003ICE
Molecular Formula:
C6H8N2S2
Molecular Weight:
172.2711
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Product Description
Catalog Number:
AG003ICE
Chemical Name:
3,3′-Dithiobis(propionitrile)
CAS Number:
42841-31-6
Molecular Formula:
C6H8N2S2
Molecular Weight:
172.2711
MDL Number:
MFCD01695421
IUPAC Name:
3-(2-cyanoethyldisulfanyl)propanenitrile
InChI:
InChI=1S/C6H8N2S2/c7-3-1-5-9-10-6-2-4-8/h1-2,5-6H2
InChI Key:
HHEYGEJOMQFDFN-UHFFFAOYSA-N
SMILES:
N#CCCSSCCC#N
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.013g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.264g/mol
Monoisotopic Mass:
172.013g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
98.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties