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34866-42-7 | 5-tert-Butyl-1,3,5-dithiazinane
CAS No: 34866-42-7 Catalog No: AG01FEYL MDL No:
Product Description
Catalog Number:
AG01FEYL
Chemical Name:
5-tert-Butyl-1,3,5-dithiazinane
CAS Number:
34866-42-7
Molecular Formula:
C7H15NS2
Molecular Weight:
177.3307
IUPAC Name:
5-tert-butyl-1,3,5-dithiazinane
InChI:
InChI=1S/C7H15NS2/c1-7(2,3)8-4-9-6-10-5-8/h4-6H2,1-3H3
InChI Key:
QPQICTWOSDRHIA-UHFFFAOYSA-N
SMILES:
CC(N1CSCSC1)(C)C
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.065g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.324g/mol
Monoisotopic Mass:
177.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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