Home Halogens Benzyl chloromethyl ether

Benzyl chloromethyl ether

CAS No.:
3587-60-8
Catalog Number:
AG0034IA
Molecular Formula:
C8H9ClO
Molecular Weight:
156.6095
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Purity
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30g
~70%
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United States
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Product Description
Catalog Number:
AG0034IA
Chemical Name:
Benzyl chloromethyl ether
CAS Number:
3587-60-8
Molecular Formula:
C8H9ClO
Molecular Weight:
156.6095
MDL Number:
MFCD00000886
IUPAC Name:
chloromethoxymethylbenzene
InChI:
InChI=1S/C8H9ClO/c9-7-10-6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChI Key:
LADPCMZCENPFGV-UHFFFAOYSA-N
SMILES:
ClCOCc1ccccc1
EC Number:
252-527-2
Properties
Complexity:
79.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.034g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.609g/mol
Monoisotopic Mass:
156.034g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Synthesis of novel uracil non-nucleoside derivatives as potential reverse transcriptase inhibitors of HIV-1. Archiv der Pharmazie 20091101
Synthesis of non-nucleosides: 7- and 1,3-substituents of new pyrrolo[2,3-d]pyrimidin-4-ones on antiviral activity. Archiv der Pharmazie 20060401
Synthesis of 2-(aminocarbonylmethylthio)-1H-imidazoles as novel Capravirine analogues. Bioorganic & medicinal chemistry 20050701
Rearrangements concerted with fragmentation of cyclopropylmethoxychlorocarbene and cyclobutoxychlorocarbene in hydrocarbon solvents and Ar matrices. Journal of the American Chemical Society 20040714
Synthesis of 2-methylsulfanyl-1H-imidazoles as novel non-nucleoside reverse transcriptase inhibitors (NNRTIs). Archiv der Pharmazie 20030601
Enantioselective synthesis of imperanene, a platelet aggregation inhibitor. Organic letters 20010920
Properties