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Home > Quinoline > 1160264-84-5
1160264-84-5 | 2-(4-Isobutoxyphenyl)quinoline-4-carbonyl chloride
CAS No: 1160264-84-5 Catalog No: AG00HDNU MDL No:MFCD03421068
Product Description
Catalog Number:
AG00HDNU
Chemical Name:
2-(4-Isobutoxyphenyl)quinoline-4-carbonyl chloride
CAS Number:
1160264-84-5
Molecular Formula:
C20H18ClNO2
Molecular Weight:
339.8154
MDL Number:
MFCD03421068
IUPAC Name:
2-[4-(2-methylpropoxy)phenyl]quinoline-4-carbonyl chloride
InChI:
InChI=1S/C20H18ClNO2/c1-13(2)12-24-15-9-7-14(8-10-15)19-11-17(20(21)23)16-5-3-4-6-18(16)22-19/h3-11,13H,12H2,1-2H3
InChI Key:
QQJZYARCNPUYQI-UHFFFAOYSA-N
SMILES:
CC(COc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Cl)C
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.103g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.819g/mol
Monoisotopic Mass:
339.103g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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