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14999-71-4 | Quinoline, perchlorate (1:1)
CAS No: 14999-71-4 Catalog No: AG001M6S MDL No:
Product Description
Catalog Number:
AG001M6S
Chemical Name:
Quinoline, perchlorate (1:1)
CAS Number:
14999-71-4
Molecular Formula:
C9H8ClNO4
Molecular Weight:
229.6171
IUPAC Name:
perchloric acid;quinoline
InChI:
InChI=1S/C9H7N.ClHO4/c1-2-6-9-8(4-1)5-3-7-10-9;2-1(3,4)5/h1-7H;(H,2,3,4,5)
InChI Key:
KLJOVDQWQVYFFR-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)nccc2.O[Cl](=O)(=O)=O
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.014g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.616g/mol
Monoisotopic Mass:
229.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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