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Home > Bromides > 1283658-84-3
1283658-84-3 | 4,7,10,13-Tetraoxaheptadec-15-enoic acid, 17-bromo-, 2,5-dioxo-1-pyrrolidinyl ester, (15E)-
CAS No: 1283658-84-3 Catalog No: AG000Y0L MDL No:
Product Description
Catalog Number:
AG000Y0L
Chemical Name:
4,7,10,13-Tetraoxaheptadec-15-enoic acid, 17-bromo-, 2,5-dioxo-1-pyrrolidinyl ester, (15E)-
CAS Number:
1283658-84-3
Molecular Formula:
C17H26BrNO8
Molecular Weight:
452.2942
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[(E)-4-bromobut-2-enoxy]ethoxy]ethoxy]ethoxy]propanoate
InChI:
InChI=1S/C17H26BrNO8/c18-6-1-2-7-23-9-11-25-13-14-26-12-10-24-8-5-17(22)27-19-15(20)3-4-16(19)21/h1-2H,3-14H2/b2-1+
InChI Key:
WSWPUIFOGNMUKF-OWOJBTEDSA-N
SMILES:
BrC/C=C/COCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
451.084g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
452.298g/mol
Monoisotopic Mass:
451.084g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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