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102571-32-4 | 2-Furanbutanaminium, N,N,N,δ-tetramethyl-, iodide (1:1)
CAS No: 102571-32-4 Catalog No: AG0007RO MDL No:
Product Description
Catalog Number:
AG0007RO
Chemical Name:
2-Furanbutanaminium, N,N,N,δ-tetramethyl-, iodide (1:1)
CAS Number:
102571-32-4
Molecular Formula:
C12H22INO
Molecular Weight:
323.2136
IUPAC Name:
4-(furan-2-yl)pentyl-trimethylazanium;iodide
InChI:
InChI=1S/C12H22NO.HI/c1-11(12-8-6-10-14-12)7-5-9-13(2,3)4;/h6,8,10-11H,5,7,9H2,1-4H3;1H/q+1;/p-1
InChI Key:
YXIAJNFBQVDDPB-UHFFFAOYSA-M
SMILES:
CC(c1ccco1)CCC[N+](C)(C)C.[I-]
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.075g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.218g/mol
Monoisotopic Mass:
323.075g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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