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13178-38-6 | Morpholine, 4-octadecyl-, 4-oxide
CAS No: 13178-38-6 Catalog No: AG000ZQH MDL No:
Product Description
Catalog Number:
AG000ZQH
Chemical Name:
Morpholine, 4-octadecyl-, 4-oxide
CAS Number:
13178-38-6
Molecular Formula:
C22H45NO2
Molecular Weight:
355.5982
IUPAC Name:
4-octadecyl-4-oxidomorpholin-4-ium
InChI:
InChI=1S/C22H45NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(24)19-21-25-22-20-23/h2-22H2,1H3
InChI Key:
RUDLMVHSYZURRL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC[N+]1([O-])CCOCC1
NSC Number:
261428
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.345g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
355.607g/mol
Monoisotopic Mass:
355.345g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
27.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.2
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