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127698-41-3 | Cyclohexanamine, N-cyclohexyl-N-ethyl-, N-oxide (9CI)
CAS No: 127698-41-3 Catalog No: AG000XBO MDL No:
Product Description
Catalog Number:
AG000XBO
Chemical Name:
Cyclohexanamine, N-cyclohexyl-N-ethyl-, N-oxide (9CI)
CAS Number:
127698-41-3
Molecular Formula:
C14H27NO
Molecular Weight:
225.3703
IUPAC Name:
N-cyclohexyl-N-ethylcyclohexanamine oxide
InChI:
InChI=1S/C14H27NO/c1-2-15(16,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h13-14H,2-12H2,1H3
InChI Key:
JMZNVJPTLJMCQV-UHFFFAOYSA-N
SMILES:
CC[N+](C1CCCCC1)(C1CCCCC1)[O-]
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.209g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.376g/mol
Monoisotopic Mass:
225.209g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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