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Home > Quinoline > 111545-64-3
111545-64-3 | 3-Quinolinecarbonyl chloride, hydrochloride
CAS No: 111545-64-3 Catalog No: AG007ADH MDL No:
Product Description
Catalog Number:
AG007ADH
Chemical Name:
3-Quinolinecarbonyl chloride, hydrochloride
CAS Number:
111545-64-3
Molecular Formula:
C10H7Cl2NO
Molecular Weight:
228.0747
IUPAC Name:
quinoline-3-carbonyl chloride;hydrochloride
InChI:
InChI=1S/C10H6ClNO.ClH/c11-10(13)8-5-7-3-1-2-4-9(7)12-6-8;/h1-6H;1H
InChI Key:
BXOABPTZXHSRMD-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cnc2c(c1)cccc2.Cl
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.99g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.072g/mol
Monoisotopic Mass:
226.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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