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88362-97-4 | 9H-Fluorene, 9,9-bis[(phenylmethyl)thio]-
CAS No: 88362-97-4 Catalog No: AG004MV2 MDL No:
Product Description
Catalog Number:
AG004MV2
Chemical Name:
9H-Fluorene, 9,9-bis[(phenylmethyl)thio]-
CAS Number:
88362-97-4
Molecular Formula:
C27H22S2
Molecular Weight:
410.5936
IUPAC Name:
9,9-bis(benzylsulfanyl)fluorene
InChI:
InChI=1S/C27H22S2/c1-3-11-21(12-4-1)19-28-27(29-20-22-13-5-2-6-14-22)25-17-9-7-15-23(25)24-16-8-10-18-26(24)27/h1-18H,19-20H2
InChI Key:
AFDHOFXMMBUGTI-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CSC1(SCc2ccccc2)c2ccccc2c2c1cccc2
Properties
Complexity:
459
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.116g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
410.593g/mol
Monoisotopic Mass:
410.116g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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