200,000+ products from a single source!
sales@angenechem.com
117032-51-6 | Hexanoic acid, 6-[(2,2,2-trifluoroacetyl)amino]-, 2,5-dioxo-1-pyrrolidinyl ester
CAS No: 117032-51-6 Catalog No: AG000DL1 MDL No:MFCD01863466
Product Description
Catalog Number:
AG000DL1
Chemical Name:
Hexanoic acid, 6-[(2,2,2-trifluoroacetyl)amino]-, 2,5-dioxo-1-pyrrolidinyl ester
CAS Number:
117032-51-6
Molecular Formula:
C12H15F3N2O5
Molecular Weight:
324.2531
MDL Number:
MFCD01863466
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) 6-[(2,2,2-trifluoroacetyl)amino]hexanoate
InChI:
InChI=1S/C12H15F3N2O5/c13-12(14,15)11(21)16-7-3-1-2-4-10(20)22-17-8(18)5-6-9(17)19/h1-7H2,(H,16,21)
InChI Key:
HROQVGGEVAAQOE-UHFFFAOYSA-N
SMILES:
O=C(ON1C(=O)CCC1=O)CCCCCNC(=O)C(F)(F)F
Properties
Complexity:
448
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.093g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.256g/mol
Monoisotopic Mass:
324.093g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.