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1443345-92-3

1443345-92-3 | 3',5'-Difluoro-4'-n-propoxypropiophenone

CAS No: 1443345-92-3 Catalog No: AG01FC2O MDL No:

Product Description

Catalog Number:
AG01FC2O
Chemical Name:
3',5'-Difluoro-4'-n-propoxypropiophenone
CAS Number:
1443345-92-3
Molecular Formula:
C12H14F2O2
Molecular Weight:
228.2352
IUPAC Name:
1-(3,5-difluoro-4-propoxyphenyl)propan-1-one
InChI:
InChI=1S/C12H14F2O2/c1-3-5-16-12-9(13)6-8(7-10(12)14)11(15)4-2/h6-7H,3-5H2,1-2H3
InChI Key:
WSQMDLXBPOCMCY-UHFFFAOYSA-N
SMILES:
CCCOc1c(F)cc(cc1F)C(=O)CC

Properties

Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.096g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.239g/mol
Monoisotopic Mass:
228.096g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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