Chem 9 Bromo 9 Phenyl 9h Fluorene Dsrpl

Compound 377
  CheckMol                        TMF02:r0:m0
MF=C19H13Br MW=321.22
 20 23  0  7  0               999 V2000
    0.0000   -0.0000   -0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3253   -0.7455   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0710   -1.5620   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.7216   -0.1183   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.4910   -2.2364   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0473   -2.9583   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2661   -0.8638   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.7392   -1.2306   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.1949    1.3253   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.9819   -2.5441   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.5443   -3.3961   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.0886   -3.8694   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5204   -1.6803   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2302   -0.8993   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.6859    1.6566   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.4552   -3.9641   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.9703   -4.7687   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.4258   -3.1712   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.7035    0.5443   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.4613   -5.0764   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  1  0  0
  2  5  1  0  1  0  0
  3  6 02  0  1  0  0
  3  7 01  0  1  0  0
  4  8 02  0  2  0  0
  4  9 01  0  1  0  0
  5 10 02  0  2  0  0
  5 11 01  0  1  0  0
  6 12 01  0  1  0  0
  7 13 02  0  1  0  0
  8 14 01  0  1  0  0
  9 15 02  0  1  0  0
 10 16 01  0  1  0  0
 11 17 02  0  1  0  0
 12 18 02  0  1  0  0
 14 19 02  0  1  0  0
 16 20 02  0  1  0  0
  8 10  1  0  1  0  0
 13 18 01  0  1  0  0
 15 19 01  0  1  0  0
 17 20 01  0  1  0  0
M  END

9-Bromo-9-phenyl-9H-fluorene

₹ 0.00 0.00

Chemical Name - 9-Bromo-9-phenyl-9H-fluorene
Mol Weight - 321.216
Smiles - BrC1(c(cccc2)c2-c2c1cccc2)c1ccccc1

Property Name	Property Value
Mol Name	9-Bromo-9-phenyl-9H-fluorene
Molweight	321.216
Monoisotopic Mass	320.020061
Clogp	5.1778
Clogs	-5.779
Total Surface Area	208.32
Druglikeness	-5.4162
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Shape Index	0.45
Molecular Flexibility	0.23025
Molecular Complexity	0.78992
Fragments	1
Non H Atoms	20
Non Ch Atoms	1
Electronegative Atoms	1
Rotatable Bonds	1
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3 Atoms	1
Symmetric Atoms	8
Smiles	BrC1(c(cccc2)c2-c2c1cccc2)c1ccccc1
InChIKey	InChI=1S/C19H13Br/c20-19(14-8-2-1-3-9-14)17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13H
InChI	HYQXNCDBSALQLB-UHFFFAOYSA-N

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9-Bromo-9-phenyl-9H-fluorene