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1225683-46-4

1225683-46-4 | 2'-n-Butoxy-5'-chloroacetophenone

CAS No: 1225683-46-4 Catalog No: AG01FEBU MDL No:

Product Description

Catalog Number:
AG01FEBU
Chemical Name:
2'-n-Butoxy-5'-chloroacetophenone
CAS Number:
1225683-46-4
Molecular Formula:
C12H15ClO2
Molecular Weight:
226.6993
IUPAC Name:
1-(2-butoxy-5-chlorophenyl)ethanone
InChI:
InChI=1S/C12H15ClO2/c1-3-4-7-15-12-6-5-10(13)8-11(12)9(2)14/h5-6,8H,3-4,7H2,1-2H3
InChI Key:
BEWWNGKVOMUSNG-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1C(=O)C)Cl

Properties

Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.076g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.7g/mol
Monoisotopic Mass:
226.076g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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