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Home Other Building Blocks 4-Methoxybenzyl bromide

4-Methoxybenzyl bromide

CAS No.:
2746-25-0
Catalog Number:
AG00343F
Molecular Formula:
C8H9BrO
Molecular Weight:
201.0605
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Product Description
Catalog Number:
AG00343F
Chemical Name:
4-Methoxybenzyl bromide
CAS Number:
2746-25-0
Molecular Formula:
C8H9BrO
Molecular Weight:
201.0605
MDL Number:
MFCD00800380
IUPAC Name:
1-(bromomethyl)-4-methoxybenzene
InChI:
InChI=1S/C8H9BrO/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,6H2,1H3
InChI Key:
GIGRWGTZFONRKA-UHFFFAOYSA-N
SMILES:
BrCc1ccc(cc1)OC
Properties
Complexity:
87.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.984g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.063g/mol
Monoisotopic Mass:
199.984g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
5-[(4-Meth-oxy-benz-yl)sulfan-yl]-2-methyl-1,3,4-thia-diazole. Acta crystallographica. Section E, Structure reports online 20110101
2-[4-Chloro-3-(4-ethoxy-benz-yl)phen-yl]-1,3-dithiane. Acta crystallographica. Section E, Structure reports online 20100601
3-(4-Methoxy-benz-yl)-1-benzothio-phene. Acta crystallographica. Section E, Structure reports online 20100601
Structure-based design of pteridine reductase inhibitors targeting African sleeping sickness and the leishmaniases. Journal of medicinal chemistry 20100114
Distributed Drug Discovery, Part 2: global rehearsal of alkylating agents for the synthesis of resin-bound unnatural amino acids and virtual D(3) catalog construction. Journal of combinatorial chemistry 20090112
Solid-phase synthesis of 1,2,3-triazoles via 1,3-dipolar cycloaddition. Journal of combinatorial chemistry 20030101
Properties