The store will not work correctly when cookies are disabled.
JavaScript seems to be disabled in your browser.
For the best experience on our site, be sure to turn on Javascript in your browser.
This is a demo store. No orders will be fulfilled.
We use cookies to keep things working smoothly and to improve your experience.
Choose what’s okay for you below. See our Cookie Policy .
Accept Cookies
N,N′-Di-n-octyl-3,3′-dithiodipropionamide , CAS No.33312-01-5
Basic Description
Synonyms
FT-0667607 | J-019138 | EINECS 251-453-8 | N,NDi-(n-octyl-d17)-3,3dithiodipropionamide | NQSLUQLRQBLHJD-UHFFFAOYSA-N | Propanamide, 3,3'-dithiobis(N-octyl- | 3,3'-Dithiobis(N-octylpropionamide) | N,N'-Bis-n-octyl-3,3'-dithiopropionamide | N-octyl-3-[[3-(o
Specifications & Purity
≥95%
Storage Temp
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Carboxylic acid derivatives
Intermediate Tree Nodes
Carboxylic acid amides
Direct Parent
Secondary carboxylic acid amides
Alternative Parents
Dialkyldisulfides Sulfenyl compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Dialkyldisulfide - Secondary carboxylic acid amide - Organic disulfide - Sulfenyl compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as secondary carboxylic acid amides. These are compounds containing a secondary carboxylic acid amide functional group, with the general structure RC(=O)N(R')H (R,R'=alkyl, aryl).
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
Pubchem Sid
504756785
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504756785
IUPAC Name
N-octyl-3-[[3-(octylamino)-3-oxopropyl]disulfanyl]propanamide
INCHI
InChI=1S/C22H44N2O2S2/c1-3-5-7-9-11-13-17-23-21(25)15-19-27-28-20-16-22(26)24-18-14-12-10-8-6-4-2/h3-20H2,1-2H3,(H,23,25)(H,24,26)
InChIKey
NQSLUQLRQBLHJD-UHFFFAOYSA-N
Smiles
CCCCCCCCNC(=O)CCSSCCC(=O)NCCCCCCCC
Isomeric SMILES
CCCCCCCCNC(=O)CCSSCCC(=O)NCCCCCCCC
Molecular Weight
432.73
Reaxy-Rn
2392671
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2392671&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Soluble in Chloroform, Dichloromethane, Dimethyl Sulfoxide and Methanol
Molecular Weight
432.700 g/mol
XLogP3
6.200
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
21
Exact Mass
432.284 Da
Monoisotopic Mass
432.284 Da
Topological Polar Surface Area
109.000 Ų
Heavy Atom Count
28
Formal Charge
0
Complexity
334.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Solution Calculators
Molarity Calculator
Determine the necessary mass, volume, or concentration for preparing a solution.
Dilution Calculator
Determine the dilution needed to prepare a stock solution.
Reconstitution Calculator
Shall we send you a message when we have discounts available?
Remind me later
Allow
Thank you! Please check your email inbox to confirm.
Oops! Notifications are disabled.
G23041007