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1665-64-1 | Acetic acid, 2,2'-dithiobis-, 1,1'-dimethyl ester
CAS No: 1665-64-1 Catalog No: AG001WRY MDL No:
Product Description
Catalog Number:
AG001WRY
Chemical Name:
Acetic acid, 2,2'-dithiobis-, 1,1'-dimethyl ester
CAS Number:
1665-64-1
Molecular Formula:
C6H10O4S2
Molecular Weight:
210.2712
IUPAC Name:
methyl 2-[(2-methoxy-2-oxoethyl)disulfanyl]acetate
InChI:
InChI=1S/C6H10O4S2/c1-9-5(7)3-11-12-4-6(8)10-2/h3-4H2,1-2H3
InChI Key:
CJFDFRRZIPQFKP-UHFFFAOYSA-N
SMILES:
COC(=O)CSSCC(=O)OC
NSC Number:
638710
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.002g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.262g/mol
Monoisotopic Mass:
210.002g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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