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42841-31-6,MFCD01695421
Catalog No.:AA003I9M
42841-31-6 | 3,3′-Dithiobis(propionitrile)
Pack Size
Purity
Availability
Price(USD)
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250mg
95.0%
3 weeks  
$168.00   $118.00
- +
500mg
95.0%
3 weeks  
$181.00   $127.00
- +
1g
95.0%
3 weeks  
$195.00   $137.00
- +
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Technical Information
Catalog Number:
AA003I9M
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
Computed 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  

Synonyms
 
42841-31-6 
Propionitrile, dithiodi- 
3,3'-dithiobispropanonitrile 
3,3'-Dithiodipropiononitrile 
3,3'-Dithiobis(propionitrile) 
DTXSID10195532 
HHEYGEJOMQFDFN-UHFFFAOYSA-N 
ZINC2383131 
AKOS015912865 
3,3'-Dithiobis(propionitrile), 98% 
NE51169 
3-(2-cyano-ethyldisulfanyl)-propionitrile 
Dithiodipropionitrile 
LS-124926 
I14-49381 
3,3 inverted exclamation marka-Dithiobis(propionitrile) 
Propanenitrile, 3,3'-dithiobis- 
C6-H8-N2-S2 
CID206101 
3-[(2-cyanoethyl)disulfanyl]propanenitrile 
USAF HA-6 
BRN 1853729 
3-(2-cyanoethyldisulfanyl)propanenitrile 
AC1L4FZP 
di-(2-cyanoethyl) disulfide 
SCHEMBL97778 
Literature
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