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26475-42-3 | 4-Thiomorpholinamine, 3,5-dimethyl-, 1,1-dioxide
CAS No: 26475-42-3 Catalog No: AG002TDU MDL No:
Product Description
Catalog Number:
AG002TDU
Chemical Name:
4-Thiomorpholinamine, 3,5-dimethyl-, 1,1-dioxide
CAS Number:
26475-42-3
Molecular Formula:
C6H14N2O2S
Molecular Weight:
178.2526
IUPAC Name:
3,5-dimethyl-1,1-dioxo-1,4-thiazinan-4-amine
InChI:
InChI=1S/C6H14N2O2S/c1-5-3-11(9,10)4-6(2)8(5)7/h5-6H,3-4,7H2,1-2H3
InChI Key:
CMYRGXODRQTMHT-UHFFFAOYSA-N
SMILES:
CC1CS(=O)(=O)CC(N1N)C
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.078g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.25g/mol
Monoisotopic Mass:
178.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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