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2-bromo-9,9-difluoro-7-iodo-9H-fluorene - 98%, high purity , CAS No.1499193-60-0
Discover 2-bromo-9,9-difluoro-7-iodo-9H-fluorene by Aladdin Scientific in 98% for only $157.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
2-Bromo-9,9-difluoro-7-iodo-9H-fluorene | 1499193-60-0 | 2-bromo-9,9-difluoro-7-iodofluorene | MFCD28964411 | 9H-Fluorene, 2-bromo-9,9-difluoro-7-iodo- | SCHEMBL2707552 | DKSYLEFLMUQPDJ-UHFFFAOYSA-N | DTXSID901281284 | AMY34728 | AKOS030526045 | OL10049 | SB18155 | AS-53463 | SY09
Specifications & Purity
≥98%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Fluorenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Fluorenes
Alternative Parents
Aryl iodides Aryl bromides Organoiodides Organofluorides Organobromides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Fluorene - Aryl iodide - Aryl halide - Aryl bromide - Hydrocarbon derivative - Organoiodide - Organofluoride - Organobromide - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as fluorenes. These are compounds containing a fluorene moiety, which consists of two benzene rings connected through either a cyclopentane, cyclopentene, or cyclopenta-1,3-diene.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
IUPAC Name
2-bromo-9,9-difluoro-7-iodofluorene
INCHI
InChI=1S/C13H6BrF2I/c14-7-1-3-9-10-4-2-8(17)6-12(10)13(15,16)11(9)5-7/h1-6H
InChIKey
DKSYLEFLMUQPDJ-UHFFFAOYSA-N
Smiles
C1=CC2=C(C=C1Br)C(C3=C2C=CC(=C3)I)(F)F
Isomeric SMILES
C1=CC2=C(C=C1Br)C(C3=C2C=CC(=C3)I)(F)F
Molecular Weight
406.996
Reaxy-Rn
24609537
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24609537&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Slightly soluble (5.7E-4 g/L) (25 ºC)
Melt Point(°C)
143 °C
Molecular Weight
406.990 g/mol
XLogP3
5.100
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
0
Exact Mass
405.867 Da
Monoisotopic Mass
405.867 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
310.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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