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102769-39-1 | Acetamide, N,N-bis(2-ethylhexyl)-
CAS No: 102769-39-1 Catalog No: AG0008BN MDL No:
Product Description
Catalog Number:
AG0008BN
Chemical Name:
Acetamide, N,N-bis(2-ethylhexyl)-
CAS Number:
102769-39-1
Molecular Formula:
C18H37NO
Molecular Weight:
283.4925
IUPAC Name:
N,N-bis(2-ethylhexyl)acetamide
InChI:
InChI=1S/C18H37NO/c1-6-10-12-17(8-3)14-19(16(5)20)15-18(9-4)13-11-7-2/h17-18H,6-15H2,1-5H3
InChI Key:
KMGFVPGVMMBATJ-UHFFFAOYSA-N
SMILES:
CCCCC(CN(C(=O)C)CC(CCCC)CC)CC
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.288g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.5g/mol
Monoisotopic Mass:
283.288g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
6
Literature
| Title | Journal |
|---|---|
| Molecular recognition probes of solvation thermodynamics in solvent mixtures. | Organic & biomolecular chemistry 20111107 |
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