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102571-19-7 | Ethanaminium, 2-(bicyclo[2.2.1]hept-2-ylamino)-N,N-diethyl-N-methyl-2-oxo-, iodide, endo- (9CI)
CAS No: 102571-19-7 Catalog No: AG0007RZ MDL No:
Product Description
Catalog Number:
AG0007RZ
Chemical Name:
Ethanaminium, 2-(bicyclo[2.2.1]hept-2-ylamino)-N,N-diethyl-N-methyl-2-oxo-, iodide, endo- (9CI)
CAS Number:
102571-19-7
Molecular Formula:
C14H27IN2O
Molecular Weight:
366.2815
IUPAC Name:
[2-(2-bicyclo[2.2.1]heptanylamino)-2-oxoethyl]-diethyl-methylazanium;iodide
InChI:
InChI=1S/C14H26N2O.HI/c1-4-16(3,5-2)10-14(17)15-13-9-11-6-7-12(13)8-11;/h11-13H,4-10H2,1-3H3;1H
InChI Key:
JFURANXNHQCXIK-UHFFFAOYSA-N
SMILES:
CC[N+](CC(=O)NC1CC2CC1CC2)(CC)C.[I-]
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.117g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
366.287g/mol
Monoisotopic Mass:
366.117g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
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