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6530-09-2 | 3-Aminoquinuclidine dihydrochloride
CAS No: 6530-09-2 Catalog No: AG003IY6 MDL No:MFCD00137395
Product Description
Catalog Number:
AG003IY6
Chemical Name:
3-Aminoquinuclidine dihydrochloride
CAS Number:
6530-09-2
Molecular Formula:
C7H16Cl2N2
Molecular Weight:
199.1213
MDL Number:
MFCD00137395
IUPAC Name:
1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride
InChI:
InChI=1S/C7H14N2.2ClH/c8-7-5-9-3-1-6(7)2-4-9;;/h6-7H,1-5,8H2;2*1H
InChI Key:
STZHBULOYDCZET-UHFFFAOYSA-N
SMILES:
NC1CN2CCC1CC2.Cl.Cl
EC Number:
229-424-6
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
199.119g/mol
Monoisotopic Mass:
198.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Chemical and genetic engineering of selective ion channel-ligand interactions. | Science (New York, N.Y.) 20110902 |
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