4-Bromobenzyl Bromide
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Product Overview
Product Code
TRC-B679955
CAS Number
Product Format
Neat
Molecular Formula
C22 H28 O4
Molecular Weight
356.455
Product Categories
Product Type
Synthesis ToolsDocumentation
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Product Information
Chemical Data
Analyte Name
4-Bromobenzyl Bromide
CAS Number
589-15-1
Molecular Formula
C22 H28 O4
Molecular Weight
356.455
Accurate Mass
356.199
SMILES
CC(=O)OC1(CC[C@@H]2[C@@H]3C[C@@H](O)C4=CC(=O)CC[C@@H]4[C@@H]3CC[C@]12C)C#C
InChI
InChI=1S/C22H28O4/c1-4-22(26-13(2)23)10-8-19-17-12-20(25)18-11-14(24)5-6-15(18)16(17)7-9-21(19,22)3/h1,11,15-17,19-20,25H,5-10,12H2,2-3H3/t15-,16+,17-,19-,20-,21+,22?/m1/s1
IUPAC
[(6R,8R,9R,10R,13S,14R)-17-ethynyl-6-hydroxy-13-methyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Transport Restrictions
Air Excepted Air Dangerous
Product Type
Synthesis Tools
Product Format
Neat
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