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26366-77-8 | 1,2-Dithiolan-4-amine, N,N-dimethyl-, 1-oxide
CAS No: 26366-77-8 Catalog No: AG002SVP MDL No:
Product Description
Catalog Number:
AG002SVP
Chemical Name:
1,2-Dithiolan-4-amine, N,N-dimethyl-, 1-oxide
CAS Number:
26366-77-8
Molecular Formula:
C5H11NOS2
Molecular Weight:
165.2769
IUPAC Name:
N,N-dimethyl-1-oxodithiolan-4-amine
InChI:
InChI=1S/C5H11NOS2/c1-6(2)5-3-8-9(7)4-5/h5H,3-4H2,1-2H3
InChI Key:
BLCKTMWGTJCBML-UHFFFAOYSA-N
SMILES:
O=S1SCC(C1)N(C)C
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.028g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.269g/mol
Monoisotopic Mass:
165.028g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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