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6711-89-3 | Betainealdehyde Diethylacetal Iodide
CAS No: 6711-89-3 Catalog No: AG005R4P MDL No:
Product Description
Catalog Number:
AG005R4P
Chemical Name:
Betainealdehyde Diethylacetal Iodide
CAS Number:
6711-89-3
Molecular Formula:
C9H22INO2
Molecular Weight:
303.1809
IUPAC Name:
2,2-diethoxyethyl(trimethyl)azanium;iodide
InChI:
InChI=1S/C9H22NO2.HI/c1-6-11-9(12-7-2)8-10(3,4)5;/h9H,6-8H2,1-5H3;1H/q+1;/p-1
InChI Key:
QJBGXTFFXWVDMA-UHFFFAOYSA-M
SMILES:
CCOC(C[N+](C)(C)C)OCC.[I-]
NSC Number:
97065
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.184g/mol
Monoisotopic Mass:
303.07g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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