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131230-75-6 | 2-Azetidinone, 3-bromo-3-fluoro-1-[2-(fluoromethyl)phenyl]-
CAS No: 131230-75-6 Catalog No: AG000VRE MDL No:
Product Description
Catalog Number:
AG000VRE
Chemical Name:
2-Azetidinone, 3-bromo-3-fluoro-1-[2-(fluoromethyl)phenyl]-
CAS Number:
131230-75-6
Molecular Formula:
C10H8BrF2NO
Molecular Weight:
276.0774
IUPAC Name:
3-bromo-3-fluoro-1-[2-(fluoromethyl)phenyl]azetidin-2-one
InChI:
InChI=1S/C10H8BrF2NO/c11-10(13)6-14(9(10)15)8-4-2-1-3-7(8)5-12/h1-4H,5-6H2
InChI Key:
JZGCPMXMYBEQJH-UHFFFAOYSA-N
SMILES:
FCc1ccccc1N1CC(C1=O)(F)Br
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.976g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.081g/mol
Monoisotopic Mass:
274.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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