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Home > Other Heterocycles > 23263-93-6
23263-93-6 | 2-Thiabicyclo[2.1.0]pentane, 5,5-diphenyl-, 2,2-dioxide
CAS No: 23263-93-6 Catalog No: AG002MQB MDL No:
Product Description
Catalog Number:
AG002MQB
Chemical Name:
2-Thiabicyclo[2.1.0]pentane, 5,5-diphenyl-, 2,2-dioxide
CAS Number:
23263-93-6
Molecular Formula:
C16H14O2S
Molecular Weight:
270.3462
IUPAC Name:
5,5-diphenyl-2λ6-thiabicyclo[2.1.0]pentane 2,2-dioxide
InChI:
InChI=1S/C16H14O2S/c17-19(18)11-14-15(19)16(14,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14-15H,11H2
InChI Key:
IQHUDICJPKKSBR-UHFFFAOYSA-N
SMILES:
O=S1(=O)CC2C1C2(c1ccccc1)c1ccccc1
NSC Number:
138481
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.071g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.346g/mol
Monoisotopic Mass:
270.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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