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88330-51-2 | Methanamine, N-[[1-[2-(4-methoxyphenyl)ethyl]hexyl]oxy]-N-methyl-
CAS No: 88330-51-2 Catalog No: AG0047D0 MDL No:
Product Description
Catalog Number:
AG0047D0
Chemical Name:
Methanamine, N-[[1-[2-(4-methoxyphenyl)ethyl]hexyl]oxy]-N-methyl-
CAS Number:
88330-51-2
Molecular Formula:
C17H29NO2
Molecular Weight:
279.4177
IUPAC Name:
N-[1-(4-methoxyphenyl)octan-3-yloxy]-N-methylmethanamine
InChI:
InChI=1S/C17H29NO2/c1-5-6-7-8-17(20-18(2)3)14-11-15-9-12-16(19-4)13-10-15/h9-10,12-13,17H,5-8,11,14H2,1-4H3
InChI Key:
MGQPSGRFZMOHBC-UHFFFAOYSA-N
SMILES:
CCCCCC(ON(C)C)CCc1ccc(cc1)OC
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.22g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.424g/mol
Monoisotopic Mass:
279.22g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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