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Home > Quinoline > 1160263-02-4
1160263-02-4 | 2-(1,3-Benzodioxol-5-yl)-6,8-dimethylquinoline-4-carbonyl chloride
CAS No: 1160263-02-4 Catalog No: AG00HDKB MDL No:MFCD03421272
Product Description
Catalog Number:
AG00HDKB
Chemical Name:
2-(1,3-Benzodioxol-5-yl)-6,8-dimethylquinoline-4-carbonyl chloride
CAS Number:
1160263-02-4
Molecular Formula:
C19H14ClNO3
Molecular Weight:
339.7724
MDL Number:
MFCD03421272
IUPAC Name:
2-(1,3-benzodioxol-5-yl)-6,8-dimethylquinoline-4-carbonyl chloride
InChI:
InChI=1S/C19H14ClNO3/c1-10-5-11(2)18-13(6-10)14(19(20)22)8-15(21-18)12-3-4-16-17(7-12)24-9-23-16/h3-8H,9H2,1-2H3
InChI Key:
CQVTZUHEUNFVID-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c2c(c1)c(cc(n2)c1ccc2c(c1)OCO2)C(=O)Cl
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.066g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.775g/mol
Monoisotopic Mass:
339.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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