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1443349-04-9

1443349-04-9 | 5-Fluoro-3-iso-pentoxybenzoyl chloride

CAS No: 1443349-04-9 Catalog No: AG01FCS5 MDL No:

Product Description

Catalog Number:
AG01FCS5
Chemical Name:
5-Fluoro-3-iso-pentoxybenzoyl chloride
CAS Number:
1443349-04-9
Molecular Formula:
C12H14ClFO2
Molecular Weight:
244.6898
IUPAC Name:
3-fluoro-5-(3-methylbutoxy)benzoyl chloride
InChI:
InChI=1S/C12H14ClFO2/c1-8(2)3-4-16-11-6-9(12(13)15)5-10(14)7-11/h5-8H,3-4H2,1-2H3
InChI Key:
ODOLLMZAVDWFEG-UHFFFAOYSA-N
SMILES:
CC(CCOc1cc(F)cc(c1)C(=O)Cl)C

Properties

Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.067g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.69g/mol
Monoisotopic Mass:
244.067g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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