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20301-63-7 | Phosphorodithioic acid, S-[2-(ethylsulfonyl)ethyl] O,O-dimethyl ester
CAS No: 20301-63-7 Catalog No: AG0028N5 MDL No:
Product Description
Catalog Number:
AG0028N5
Chemical Name:
Phosphorodithioic acid, S-[2-(ethylsulfonyl)ethyl] O,O-dimethyl ester
CAS Number:
20301-63-7
Molecular Formula:
C6H15O4PS3
Molecular Weight:
278.3497
IUPAC Name:
2-ethylsulfonylethylsulfanyl-dimethoxy-sulfanylidene-λ5-phosphane
InChI:
InChI=1S/C6H15O4PS3/c1-4-14(7,8)6-5-13-11(12,9-2)10-3/h4-6H2,1-3H3
InChI Key:
GAXMYYJSILFZLT-UHFFFAOYSA-N
SMILES:
COP(=S)(SCCS(=O)(=O)CC)OC
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.987g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.336g/mol
Monoisotopic Mass:
277.987g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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