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139218-45-4 | 2,5-Furandione, dihydro-3-[(triphenylmethyl)thio]-
CAS No: 139218-45-4 Catalog No: AG001AHY MDL No:
Product Description
Catalog Number:
AG001AHY
Chemical Name:
2,5-Furandione, dihydro-3-[(triphenylmethyl)thio]-
CAS Number:
139218-45-4
Molecular Formula:
C23H18O3S
Molecular Weight:
374.4522
IUPAC Name:
3-tritylsulfanyloxolane-2,5-dione
InChI:
InChI=1S/C23H18O3S/c24-21-16-20(22(25)26-21)27-23(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16H2
InChI Key:
IPEYVCFFRVACJJ-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)CC1SC(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.098g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.454g/mol
Monoisotopic Mass:
374.098g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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