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189013-14-7 | 1,3,2-Dioxathiolane, 4-(methoxymethyl)-5-phenyl-, 2,2-dioxide
CAS No: 189013-14-7 Catalog No: AG002HP2 MDL No:
Product Description
Catalog Number:
AG002HP2
Chemical Name:
1,3,2-Dioxathiolane, 4-(methoxymethyl)-5-phenyl-, 2,2-dioxide
CAS Number:
189013-14-7
Molecular Formula:
C10H12O5S
Molecular Weight:
244.2643
IUPAC Name:
4-(methoxymethyl)-5-phenyl-1,3,2-dioxathiolane 2,2-dioxide
InChI:
InChI=1S/C10H12O5S/c1-13-7-9-10(15-16(11,12)14-9)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3
InChI Key:
CCZRMWSRYKGPLE-UHFFFAOYSA-N
SMILES:
COCC1OS(=O)(=O)OC1c1ccccc1
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.041g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.261g/mol
Monoisotopic Mass:
244.041g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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