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7-Bromo-1-indanone

CAT: 0804-HY-40202-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-40202-01Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
7-Bromo-1-indanone (7-Bromo-2,3-dihydroinden-1-one) is a phosphine ligand[1].
CAS Number
125114-77-4
Product Name Alternative
7-Bromo-2,3-dihydroinden-1-one
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Purity
99.24
Smiles
O=C(CC1)C(C1=CC=C2)=C2Br
Molecular Formula
C9H7BrO
Molecular Weight
211.06
Precautions
H302, H315, H319, H335
References & Citations
[1]Nguyen P, et al. A convenient synthesis of 7-halo-1-indanones and 8-halo-1-tetralones. J Org Chem. 2003 Dec 26;68 (26) :10195-8.
Shipping Conditions
Room Temperature
Storage Conditions
Store at room temperature 3 years
Scientific Category
Biochemical Assay Reagents
Clinical Information
Phase 1

Chemical Information

7-Bromo-2,3-dihydro-1H-inden-1-one
CAS Number125114-77-4
PubChem CID14515298
IUPAC Name7-bromo-2,3-dihydroinden-1-one
Molecular FormulaC9H7BrO
Molecular Weight211.05
XLogP2.4
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity178
SMILES
C1CC(=O)C2=C1C=CC=C2Br
InChI
InChI=1S/C9H7BrO/c10-7-3-1-2-6-4-5-8(11)9(6)7/h1-3H,4-5H2
InChIKey
ZWEODBMKCBWTTQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Bromo-2,3-dihydro-1H-inden-1-one
CAS: 125114-77-4
CID: 14515298
Formula: C9H7BrO
MW: 211.05
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight211.05
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass209.96803
Monoisotopic Mass209.96803
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity178
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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