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147697-37-8 | 9H-Fluorene, 9,9-bis[(4-chlorophenyl)thio]-
CAS No: 147697-37-8 Catalog No: AG001F34 MDL No:
Product Description
Catalog Number:
AG001F34
Chemical Name:
9H-Fluorene, 9,9-bis[(4-chlorophenyl)thio]-
CAS Number:
147697-37-8
Molecular Formula:
C25H16Cl2S2
Molecular Weight:
451.4305
IUPAC Name:
9,9-bis[(4-chlorophenyl)sulfanyl]fluorene
InChI:
InChI=1S/C25H16Cl2S2/c26-17-9-13-19(14-10-17)28-25(29-20-15-11-18(27)12-16-20)23-7-3-1-5-21(23)22-6-2-4-8-24(22)25/h1-16H
InChI Key:
ZOTHOZPJSULXDM-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)SC1(Sc2ccc(cc2)Cl)c2ccccc2c2c1cccc2
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
450.007g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
451.423g/mol
Monoisotopic Mass:
450.007g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.7
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