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1443347-74-7 | 4-n-Butoxy-3-fluorobenzoyl chloride
CAS No: 1443347-74-7 Catalog No: AG01FDYK MDL No:
Product Description
Catalog Number:
AG01FDYK
Chemical Name:
4-n-Butoxy-3-fluorobenzoyl chloride
CAS Number:
1443347-74-7
Molecular Formula:
C11H12ClFO2
Molecular Weight:
230.6632
IUPAC Name:
4-butoxy-3-fluorobenzoyl chloride
InChI:
InChI=1S/C11H12ClFO2/c1-2-3-6-15-10-5-4-8(11(12)14)7-9(10)13/h4-5,7H,2-3,6H2,1H3
InChI Key:
CPBKSKCWGJQNGH-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1F)C(=O)Cl
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.663g/mol
Monoisotopic Mass:
230.051g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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