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2933-17-7 | Morpholinium, 4-[2-(cyclohexylphenylamino)ethyl]-4-methyl-, bromide (1:1)
CAS No: 2933-17-7 Catalog No: AG002Y2N MDL No:
Product Description
Catalog Number:
AG002Y2N
Chemical Name:
Morpholinium, 4-[2-(cyclohexylphenylamino)ethyl]-4-methyl-, bromide (1:1)
CAS Number:
2933-17-7
Molecular Formula:
C19H31BrN2O
Molecular Weight:
383.3662
IUPAC Name:
N-cyclohexyl-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]aniline;bromide
InChI:
InChI=1S/C19H31N2O.BrH/c1-21(14-16-22-17-15-21)13-12-20(18-8-4-2-5-9-18)19-10-6-3-7-11-19;/h2,4-5,8-9,19H,3,6-7,10-17H2,1H3;1H/q+1;/p-1
InChI Key:
DLNHZRYSHAQHFJ-UHFFFAOYSA-M
SMILES:
C[N+]1(CCOCC1)CCN(c1ccccc1)C1CCCCC1.[Br-]
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.162g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
383.374g/mol
Monoisotopic Mass:
382.162g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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