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201341-14-2

201341-14-2 | Acetaldehyde, 2-[(4-bromophenyl)methoxy]-

CAS No: 201341-14-2 Catalog No: AG002DC9 MDL No:

Product Description

Catalog Number:
AG002DC9
Chemical Name:
Acetaldehyde, 2-[(4-bromophenyl)methoxy]-
CAS Number:
201341-14-2
Molecular Formula:
C9H9BrO2
Molecular Weight:
229.0706
IUPAC Name:
2-[(4-bromophenyl)methoxy]acetaldehyde
InChI:
InChI=1S/C9H9BrO2/c10-9-3-1-8(2-4-9)7-12-6-5-11/h1-5H,6-7H2
InChI Key:
SRMIJRWWQFMZCS-UHFFFAOYSA-N
SMILES:
O=CCOCc1ccc(cc1)Br

Properties

Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.979g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.073g/mol
Monoisotopic Mass:
227.979g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Literature

Title Journal
Asymmetric synthesis of epicylindrospermopsin via intramolecular nitrone cycloaddition. Assignment of absolute configuration. Journal of the American Chemical Society 20020508

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