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141364-20-7 | 5-Oxazolidinone, 4-bromo-3-methyl-2,2-bis(trifluoromethyl)-
CAS No: 141364-20-7 Catalog No: AG001GBD MDL No:
Product Description
Catalog Number:
AG001GBD
Chemical Name:
5-Oxazolidinone, 4-bromo-3-methyl-2,2-bis(trifluoromethyl)-
CAS Number:
141364-20-7
Molecular Formula:
C6H4BrF6NO2
Molecular Weight:
315.9959
IUPAC Name:
4-bromo-3-methyl-2,2-bis(trifluoromethyl)-1,3-oxazolidin-5-one
InChI:
InChI=1S/C6H4BrF6NO2/c1-14-2(7)3(15)16-4(14,5(8,9)10)6(11,12)13/h2H,1H3
InChI Key:
NYURPQUFKRPAJW-UHFFFAOYSA-N
SMILES:
BrC1C(=O)OC(N1C)(C(F)(F)F)C(F)(F)F
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.933g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.997g/mol
Monoisotopic Mass:
314.933g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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