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137846-59-4 | 1,3-Dioxolane, 2-methyl-2-[2-(phenylthio)cyclopentyl]-
CAS No: 137846-59-4 Catalog No: AG0013YG MDL No:
Product Description
Catalog Number:
AG0013YG
Chemical Name:
1,3-Dioxolane, 2-methyl-2-[2-(phenylthio)cyclopentyl]-
CAS Number:
137846-59-4
Molecular Formula:
C15H20O2S
Molecular Weight:
264.3831
IUPAC Name:
2-methyl-2-(2-phenylsulfanylcyclopentyl)-1,3-dioxolane
InChI:
InChI=1S/C15H20O2S/c1-15(16-10-11-17-15)13-8-5-9-14(13)18-12-6-3-2-4-7-12/h2-4,6-7,13-14H,5,8-11H2,1H3
InChI Key:
BDPZJPQYTUKOOR-UHFFFAOYSA-N
SMILES:
CC1(OCCO1)C1CCCC1Sc1ccccc1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.118g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.383g/mol
Monoisotopic Mass:
264.118g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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