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Home > Quinoline > 1160260-77-4
1160260-77-4 | 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)quinoline-4-carbonyl chloride
CAS No: 1160260-77-4 Catalog No: AG00HDIK MDL No:MFCD12198037
Product Description
Catalog Number:
AG00HDIK
Chemical Name:
2-(2,3-Dihydro-1,4-benzodioxin-6-yl)quinoline-4-carbonyl chloride
CAS Number:
1160260-77-4
Molecular Formula:
C18H12ClNO3
Molecular Weight:
325.7458
MDL Number:
MFCD12198037
IUPAC Name:
2-(2,3-dihydro-1,4-benzodioxin-6-yl)quinoline-4-carbonyl chloride
InChI:
InChI=1S/C18H12ClNO3/c19-18(21)13-10-15(20-14-4-2-1-3-12(13)14)11-5-6-16-17(9-11)23-8-7-22-16/h1-6,9-10H,7-8H2
InChI Key:
QIJBWABLTHWMFS-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCCO2
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.051g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.748g/mol
Monoisotopic Mass:
325.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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