Home Halogens 5-(3-chloro-4-methoxyphenyl)-2-(chloromethyl)-1,3-oxazole

5-(3-chloro-4-methoxyphenyl)-2-(chloromethyl)-1,3-oxazole

CAS No.:
1215990-56-9
Catalog Number:
AG01ELU4
Molecular Formula:
C11H9Cl2NO2
Molecular Weight:
258.1007
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Product Description
Catalog Number:
AG01ELU4
Chemical Name:
5-(3-chloro-4-methoxyphenyl)-2-(chloromethyl)-1,3-oxazole
CAS Number:
1215990-56-9
Molecular Formula:
C11H9Cl2NO2
Molecular Weight:
258.1007
MDL Number:
MFCD14531685
IUPAC Name:
5-(3-chloro-4-methoxyphenyl)-2-(chloromethyl)-1,3-oxazole
InChI:
InChI=1S/C11H9Cl2NO2/c1-15-9-3-2-7(4-8(9)13)10-6-14-11(5-12)16-10/h2-4,6H,5H2,1H3
InChI Key:
CGPXKBXSGIRLBE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Cl)c1cnc(o1)CCl
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.001g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.098g/mol
Monoisotopic Mass:
257.001g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties