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131230-67-6 | 2-Azetidinone, 1-[2-(chloromethyl)phenyl]-3,3-difluoro-
CAS No: 131230-67-6 Catalog No: AG000VRF MDL No:
Product Description
Catalog Number:
AG000VRF
Chemical Name:
2-Azetidinone, 1-[2-(chloromethyl)phenyl]-3,3-difluoro-
CAS Number:
131230-67-6
Molecular Formula:
C10H8ClF2NO
Molecular Weight:
231.6264
IUPAC Name:
1-[2-(chloromethyl)phenyl]-3,3-difluoroazetidin-2-one
InChI:
InChI=1S/C10H8ClF2NO/c11-5-7-3-1-2-4-8(7)14-6-10(12,13)9(14)15/h1-4H,5-6H2
InChI Key:
XFNBRLSUCYVXKP-UHFFFAOYSA-N
SMILES:
ClCc1ccccc1N1CC(C1=O)(F)F
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.627g/mol
Monoisotopic Mass:
231.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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