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20763-38-6 | Benzenepropanaminium, N,N,N-trimethyl-γ-phenyl-, iodide (1:1)
CAS No: 20763-38-6 Catalog No: AG002J6S MDL No:
Product Description
Catalog Number:
AG002J6S
Chemical Name:
Benzenepropanaminium, N,N,N-trimethyl-γ-phenyl-, iodide (1:1)
CAS Number:
20763-38-6
Molecular Formula:
C18H24IN
Molecular Weight:
381.2943
IUPAC Name:
3,3-diphenylpropyl(trimethyl)azanium;iodide
InChI:
InChI=1S/C18H24N.HI/c1-19(2,3)15-14-18(16-10-6-4-7-11-16)17-12-8-5-9-13-17;/h4-13,18H,14-15H2,1-3H3;1H/q+1;/p-1
InChI Key:
SADSTYGXNWGWOS-UHFFFAOYSA-M
SMILES:
C[N+](CCC(c1ccccc1)c1ccccc1)(C)C.[I-]
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.095g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
381.301g/mol
Monoisotopic Mass:
381.095g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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