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113715-03-0 | 2,4-Pentanedione, 3-(10-aminodecyl)-
CAS No: 113715-03-0 Catalog No: AG0009FJ MDL No:
Product Description
Catalog Number:
AG0009FJ
Chemical Name:
2,4-Pentanedione, 3-(10-aminodecyl)-
CAS Number:
113715-03-0
Molecular Formula:
C15H29NO2
Molecular Weight:
255.3963
IUPAC Name:
3-(10-aminodecyl)pentane-2,4-dione
InChI:
InChI=1S/C15H29NO2/c1-13(17)15(14(2)18)11-9-7-5-3-4-6-8-10-12-16/h15H,3-12,16H2,1-2H3
InChI Key:
AIJGNGPXXOJOJO-UHFFFAOYSA-N
SMILES:
NCCCCCCCCCCC(C(=O)C)C(=O)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.22g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.402g/mol
Monoisotopic Mass:
255.22g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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