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807618-44-6 | 9H-Fluorene-9,9-diethanol, 2,7-dibromo-
CAS No: 807618-44-6 Catalog No: AG0051FG MDL No:
Product Description
Catalog Number:
AG0051FG
Chemical Name:
9H-Fluorene-9,9-diethanol, 2,7-dibromo-
CAS Number:
807618-44-6
Molecular Formula:
C17H16Br2O2
Molecular Weight:
412.1157
IUPAC Name:
2-[2,7-dibromo-9-(2-hydroxyethyl)fluoren-9-yl]ethanol
InChI:
InChI=1S/C17H16Br2O2/c18-11-1-3-13-14-4-2-12(19)10-16(14)17(5-7-20,6-8-21)15(13)9-11/h1-4,9-10,20-21H,5-8H2
InChI Key:
LXSAALCCSMKXOE-UHFFFAOYSA-N
SMILES:
OCCC1(CCO)c2cc(Br)ccc2c2c1cc(Br)cc2
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
411.95g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
412.121g/mol
Monoisotopic Mass:
409.952g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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