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125039-11-4 | 2H-1,3-Oxazine-2-thione, tetrahydro-4,4,5,6-tetramethyl-
CAS No: 125039-11-4 Catalog No: AG000N19 MDL No:
Product Description
Catalog Number:
AG000N19
Chemical Name:
2H-1,3-Oxazine-2-thione, tetrahydro-4,4,5,6-tetramethyl-
CAS Number:
125039-11-4
Molecular Formula:
C8H15NOS
Molecular Weight:
173.2758
IUPAC Name:
4,4,5,6-tetramethyl-1,3-oxazinane-2-thione
InChI:
InChI=1S/C8H15NOS/c1-5-6(2)10-7(11)9-8(5,3)4/h5-6H,1-4H3,(H,9,11)
InChI Key:
JATVHRJLAQDUMJ-UHFFFAOYSA-N
SMILES:
S=C1OC(C)C(C(N1)(C)C)C
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.087g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.274g/mol
Monoisotopic Mass:
173.087g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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