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117341-57-8 | 2-Propanone, 3-bromo-1,1,1-trifluoro-, oxime
CAS No: 117341-57-8 Catalog No: AG000E5U MDL No:MFCD08461589
Product Description
Catalog Number:
AG000E5U
Chemical Name:
2-Propanone, 3-bromo-1,1,1-trifluoro-, oxime
CAS Number:
117341-57-8
Molecular Formula:
C3H3BrF3NO
Molecular Weight:
205.9612
MDL Number:
MFCD08461589
IUPAC Name:
N-(3-bromo-1,1,1-trifluoropropan-2-ylidene)hydroxylamine
InChI:
InChI=1S/C3H3BrF3NO/c4-1-2(8-9)3(5,6)7/h9H,1H2
InChI Key:
GTAMTJKIIPLJSN-UHFFFAOYSA-N
SMILES:
BrCC(=NO)C(F)(F)F
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.935g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.962g/mol
Monoisotopic Mass:
204.935g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.1
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