Home Other Building Blocks 4,4'-DICHLOROBUTYROPHENONE

4,4'-DICHLOROBUTYROPHENONE

CAS No.:
40877-09-6
Catalog Number:
AG003KF0
Molecular Formula:
C10H10Cl2O
Molecular Weight:
217.0918
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Product Description
Catalog Number:
AG003KF0
Chemical Name:
4,4'-DICHLOROBUTYROPHENONE
CAS Number:
40877-09-6
Molecular Formula:
C10H10Cl2O
Molecular Weight:
217.0918
MDL Number:
MFCD00018993
IUPAC Name:
4-chloro-1-(4-chlorophenyl)butan-1-one
InChI:
InChI=1S/C10H10Cl2O/c11-7-1-2-10(13)8-3-5-9(12)6-4-8/h3-6H,1-2,7H2
InChI Key:
UKCHLVFIVJBCKE-UHFFFAOYSA-N
SMILES:
ClCCCC(=O)c1ccc(cc1)Cl
EC Number:
255-123-4
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.011g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.089g/mol
Monoisotopic Mass:
216.011g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties