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Home > Bromides > 1624260-58-7
1624260-58-7 | Ethanone, 1-[5-bromo-3-(2,5-dimethyl-1H-pyrrol-1-yl)-2-fluorophenyl]-
CAS No: 1624260-58-7 Catalog No: AG001T3X MDL No:
Product Description
Catalog Number:
AG001T3X
Chemical Name:
Ethanone, 1-[5-bromo-3-(2,5-dimethyl-1H-pyrrol-1-yl)-2-fluorophenyl]-
CAS Number:
1624260-58-7
Molecular Formula:
C14H13BrFNO
Molecular Weight:
310.1615
IUPAC Name:
1-[5-bromo-3-(2,5-dimethylpyrrol-1-yl)-2-fluorophenyl]ethanone
InChI:
InChI=1S/C14H13BrFNO/c1-8-4-5-9(2)17(8)13-7-11(15)6-12(10(3)18)14(13)16/h4-7H,1-3H3
InChI Key:
ANHOSYYKTNGAAR-UHFFFAOYSA-N
SMILES:
Brc1cc(C(=O)C)c(c(c1)n1c(C)ccc1C)F
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.016g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.166g/mol
Monoisotopic Mass:
309.016g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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