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23545-62-2 | Thiosulfuric acid (H2S2O3), S-[2-[(2-cyanoethyl)amino]-2-methylpropyl] ester
CAS No: 23545-62-2 Catalog No: AG002NNQ MDL No:
Product Description
Catalog Number:
AG002NNQ
Chemical Name:
Thiosulfuric acid (H2S2O3), S-[2-[(2-cyanoethyl)amino]-2-methylpropyl] ester
CAS Number:
23545-62-2
IUPAC Name:
2-(2-cyanoethylamino)-2-methyl-1-sulfosulfanylpropane
InChI:
InChI=1S/C7H14N2O3S2/c1-7(2,9-5-3-4-8)6-13-14(10,11)12/h9H,3,5-6H2,1-2H3,(H,10,11,12)
InChI Key:
DUDYCTFOKLFKCC-UHFFFAOYSA-N
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.045g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.32g/mol
Monoisotopic Mass:
238.045g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.9
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