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332382-81-7 | 6-Chloro[1,3]dioxolo[4,5-g]quinoline-7-carboxaldehyde
CAS No: 332382-81-7 Catalog No: AG003N54 MDL No:MFCD02049248
Product Description
Catalog Number:
AG003N54
Chemical Name:
6-Chloro[1,3]dioxolo[4,5-g]quinoline-7-carboxaldehyde
CAS Number:
332382-81-7
Molecular Formula:
C11H6ClNO3
Molecular Weight:
235.6232
MDL Number:
MFCD02049248
IUPAC Name:
6-chloro-[1,3]dioxolo[4,5-g]quinoline-7-carbaldehyde
InChI:
InChI=1S/C11H6ClNO3/c12-11-7(4-14)1-6-2-9-10(16-5-15-9)3-8(6)13-11/h1-4H,5H2
InChI Key:
BFMGNLHCLPBIHN-UHFFFAOYSA-N
SMILES:
O=Cc1cc2cc3OCOc3cc2nc1Cl
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.004g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.623g/mol
Monoisotopic Mass:
235.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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