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749929-04-2 | 1-(4-Bromo-2-fluorophenyl)cyclobutanecarbonitrile
CAS No: 749929-04-2 Catalog No: AG01EN23 MDL No:
Product Description
Catalog Number:
AG01EN23
Chemical Name:
1-(4-Bromo-2-fluorophenyl)cyclobutanecarbonitrile
CAS Number:
749929-04-2
IUPAC Name:
1-(4-bromo-2-fluorophenyl)cyclobutane-1-carbonitrile
InChI:
InChI=1S/C11H9BrFN/c12-8-2-3-9(10(13)6-8)11(7-14)4-1-5-11/h2-3,6H,1,4-5H2
InChI Key:
UCOCUNWNHVTRDH-UHFFFAOYSA-N
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.99g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.102g/mol
Monoisotopic Mass:
252.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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