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1268257-44-8 | 2-Propenoic acid, 2-methyl-, 2-methyl-2-[[(trifluoromethyl)sulfonyl]amino]propyl ester
CAS No: 1268257-44-8 Catalog No: AG000TA6 MDL No:
Product Description
Catalog Number:
AG000TA6
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-methyl-2-[[(trifluoromethyl)sulfonyl]amino]propyl ester
CAS Number:
1268257-44-8
Molecular Formula:
C9H14F3NO4S
Molecular Weight:
289.2720
IUPAC Name:
[2-methyl-2-(trifluoromethylsulfonylamino)propyl] 2-methylprop-2-enoate
InChI:
InChI=1S/C9H14F3NO4S/c1-6(2)7(14)17-5-8(3,4)13-18(15,16)9(10,11)12/h13H,1,5H2,2-4H3
InChI Key:
HQWREDMBXIRTBO-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)OCC(NS(=O)(=O)C(F)(F)F)(C)C
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.06g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.269g/mol
Monoisotopic Mass:
289.06g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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