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40635-67-4 | 2-Acetoxy-2-methylpropionyl bromide
CAS No: 40635-67-4 Catalog No: AG003GAN MDL No:MFCD00040923
Product Description
Catalog Number:
AG003GAN
Chemical Name:
2-Acetoxy-2-methylpropionyl bromide
CAS Number:
40635-67-4
Molecular Formula:
C6H9BrO3
Molecular Weight:
209.0379
MDL Number:
MFCD00040923
IUPAC Name:
(1-bromo-2-methyl-1-oxopropan-2-yl) acetate
InChI:
InChI=1S/C6H9BrO3/c1-4(8)10-6(2,3)5(7)9/h1-3H3
InChI Key:
OOKAXSHFTDPZHP-UHFFFAOYSA-N
SMILES:
CC(=O)OC(C(=O)Br)(C)C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.974g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.039g/mol
Monoisotopic Mass:
207.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Synthesis of triazole nucleoside derivatives. | Nucleosides, nucleotides & nucleic acids 20030401 |
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