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924265-81-6 | 2-Oxazolidinethione, 4-(2,4,6-trimethylphenyl)-, (4R)-
CAS No: 924265-81-6 Catalog No: AG0065V9 MDL No:
Product Description
Catalog Number:
AG0065V9
Chemical Name:
2-Oxazolidinethione, 4-(2,4,6-trimethylphenyl)-, (4R)-
CAS Number:
924265-81-6
Molecular Formula:
C12H15NOS
Molecular Weight:
221.3186
IUPAC Name:
(4R)-4-(2,4,6-trimethylphenyl)-1,3-oxazolidine-2-thione
InChI:
InChI=1S/C12H15NOS/c1-7-4-8(2)11(9(3)5-7)10-6-14-12(15)13-10/h4-5,10H,6H2,1-3H3,(H,13,15)/t10-/m0/s1
InChI Key:
ADWOZRWANUILQH-JTQLQIEISA-N
SMILES:
S=C1OC[C@H](N1)c1c(C)cc(cc1C)C
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
221.087g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.318g/mol
Monoisotopic Mass:
221.087g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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