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126577-49-9 | 1,3,2-Dioxathiolane, 5-methyl-4,4-diphenyl-, 2-oxide, (2R,5S)-
CAS No: 126577-49-9 Catalog No: AG000SXV MDL No:
Product Description
Catalog Number:
AG000SXV
Chemical Name:
1,3,2-Dioxathiolane, 5-methyl-4,4-diphenyl-, 2-oxide, (2R,5S)-
CAS Number:
126577-49-9
Molecular Formula:
C15H14O3S
Molecular Weight:
274.3349
IUPAC Name:
(2R,5S)-5-methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide
InChI:
InChI=1S/C15H14O3S/c1-12-15(18-19(16)17-12,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12H,1H3/t12-,19+/m0/s1
InChI Key:
ACONWRLGPDTDKX-HXPMCKFVSA-N
SMILES:
C[C@@H]1O[S@@](=O)OC1(c1ccccc1)c1ccccc1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
274.066g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.334g/mol
Monoisotopic Mass:
274.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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