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169169-49-7 | Phenol, 4,4'-(9H-fluoren-9-ylidene)bis[2-bromo-
CAS No: 169169-49-7 Catalog No: AG001YJ4 MDL No:
Product Description
Catalog Number:
AG001YJ4
Chemical Name:
Phenol, 4,4'-(9H-fluoren-9-ylidene)bis[2-bromo-
CAS Number:
169169-49-7
Molecular Formula:
C25H16Br2O2
Molecular Weight:
508.2013
IUPAC Name:
2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol
InChI:
InChI=1S/C25H16Br2O2/c26-21-13-15(9-11-23(21)28)25(16-10-12-24(29)22(27)14-16)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14,28-29H
InChI Key:
ZKTNABJAOZQJCM-UHFFFAOYSA-N
SMILES:
Brc1cc(ccc1O)C1(c2ccc(c(c2)Br)O)c2ccccc2c2c1cccc2
Properties
Complexity:
533
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
507.95g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
508.209g/mol
Monoisotopic Mass:
505.952g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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