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82846-49-9 | [methyl(nitroso)amino]methyl diethylcarbamodithioate
CAS No: 82846-49-9 Catalog No: AG004WK1 MDL No:
Product Description
Catalog Number:
AG004WK1
Chemical Name:
[methyl(nitroso)amino]methyl diethylcarbamodithioate
CAS Number:
82846-49-9
Molecular Formula:
C7H15N3OS2
Molecular Weight:
221.3435
IUPAC Name:
[methyl(nitroso)amino]methyl N,N-diethylcarbamodithioate
InChI:
InChI=1S/C7H15N3OS2/c1-4-10(5-2)7(12)13-6-9(3)8-11/h4-6H2,1-3H3
InChI Key:
UYBNJSPLSVUCDG-UHFFFAOYSA-N
SMILES:
CCN(C(=S)SCN(N=O)C)CC
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.066g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.337g/mol
Monoisotopic Mass:
221.066g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
93.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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