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6505-86-8 | 3-(1-Methylpyrrolidin-2-yl)pyridine sulfate
CAS No: 6505-86-8 Catalog No: AG003T3P MDL No:MFCD00148918
Product Description
Catalog Number:
AG003T3P
Chemical Name:
3-(1-Methylpyrrolidin-2-yl)pyridine sulfate
CAS Number:
6505-86-8
Molecular Formula:
C10H16N2O4S
Molecular Weight:
260.3100
MDL Number:
MFCD00148918
IUPAC Name:
3-(1-methylpyrrolidin-2-yl)pyridine;sulfuric acid
InChI:
InChI=1S/C10H14N2.H2O4S/c1-12-7-3-5-10(12)9-4-2-6-11-8-9;1-5(2,3)4/h2,4,6,8,10H,3,5,7H2,1H3;(H2,1,2,3,4)
InChI Key:
YHRJAJWWHFGBMV-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)O.CN1CCCC1c1cccnc1
UN Number:
1658
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.083g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.308g/mol
Monoisotopic Mass:
260.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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