Home Other Building Blocks 2,2'-Dithiobisacetic Acid Bis(2-Ethylhexyl) Ester

2,2'-Dithiobisacetic Acid Bis(2-Ethylhexyl) Ester

CAS No.:
62268-47-7
Catalog Number:
AG0036Y9
Molecular Formula:
C20H38O4S2
Molecular Weight:
406.6433
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Product Description
Catalog Number:
AG0036Y9
Chemical Name:
2,2'-Dithiobisacetic Acid Bis(2-Ethylhexyl) Ester
CAS Number:
62268-47-7
Molecular Formula:
C20H38O4S2
Molecular Weight:
406.6433
MDL Number:
MFCD01937188
IUPAC Name:
2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate
InChI:
InChI=1S/C20H38O4S2/c1-5-9-11-17(7-3)13-23-19(21)15-25-26-16-20(22)24-14-18(8-4)12-10-6-2/h17-18H,5-16H2,1-4H3
InChI Key:
YREDCFUZMPDCSM-UHFFFAOYSA-N
SMILES:
CCCCC(COC(=O)CSSCC(=O)OCC(CCCC)CC)CC
EC Number:
404-510-8
Properties
Complexity:
330  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
406.221g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
406.64g/mol
Monoisotopic Mass:
406.221g/mol
Rotatable Bond Count:
19  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
7  
Properties