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14464-32-5 | Octadecanoic acid, 2,5-dioxo-1-pyrrolidinyl ester
CAS No: 14464-32-5 Catalog No: AG001JWC MDL No:MFCD00050403
Product Description
Catalog Number:
AG001JWC
Chemical Name:
Octadecanoic acid, 2,5-dioxo-1-pyrrolidinyl ester
CAS Number:
14464-32-5
Molecular Formula:
C22H39NO4
Molecular Weight:
381.5494
MDL Number:
MFCD00050403
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) octadecanoate
InChI:
InChI=1S/C22H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(26)27-23-20(24)18-19-21(23)25/h2-19H2,1H3
InChI Key:
ZERWDZDNDJBYKA-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.288g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
381.557g/mol
Monoisotopic Mass:
381.288g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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