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862587-60-8 | 1,3-Dioxolane-2-acetamide, 2-nonyl-N-[(1S)-2-oxocyclohexyl]-
CAS No: 862587-60-8 Catalog No: AG004S1Q MDL No:
Product Description
Catalog Number:
AG004S1Q
Chemical Name:
1,3-Dioxolane-2-acetamide, 2-nonyl-N-[(1S)-2-oxocyclohexyl]-
CAS Number:
862587-60-8
Molecular Formula:
C20H35NO4
Molecular Weight:
353.4962
IUPAC Name:
2-(2-nonyl-1,3-dioxolan-2-yl)-N-[(1S)-2-oxocyclohexyl]acetamide
InChI:
InChI=1S/C20H35NO4/c1-2-3-4-5-6-7-10-13-20(24-14-15-25-20)16-19(23)21-17-11-8-9-12-18(17)22/h17H,2-16H2,1H3,(H,21,23)/t17-/m0/s1
InChI Key:
LRTFTWRYVJLWHK-KRWDZBQOSA-N
SMILES:
CCCCCCCCCC1(OCCO1)CC(=O)N[C@H]1CCCCC1=O
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
353.257g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
353.503g/mol
Monoisotopic Mass:
353.257g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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