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Home > Fluorides > 1443328-93-5
1443328-93-5 | 4',5'-Difluoro-3'-n-pentoxypropiophenone
CAS No: 1443328-93-5 Catalog No: AG01FC1T MDL No:
Product Description
Catalog Number:
AG01FC1T
Chemical Name:
4',5'-Difluoro-3'-n-pentoxypropiophenone
CAS Number:
1443328-93-5
Molecular Formula:
C14H18F2O2
Molecular Weight:
256.2883
IUPAC Name:
1-(3,4-difluoro-5-pentoxyphenyl)propan-1-one
InChI:
InChI=1S/C14H18F2O2/c1-3-5-6-7-18-13-9-10(12(17)4-2)8-11(15)14(13)16/h8-9H,3-7H2,1-2H3
InChI Key:
NSSVGORBUZWEIC-UHFFFAOYSA-N
SMILES:
CCCCCOc1cc(cc(c1F)F)C(=O)CC
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.127g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.293g/mol
Monoisotopic Mass:
256.127g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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