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1160255-01-5 | 6,8-Dimethyl-2-(4-propylphenyl)quinoline-4-carbonyl chloride
CAS No: 1160255-01-5 Catalog No: AG00HDEM MDL No:MFCD03421242
Product Description
Catalog Number:
AG00HDEM
Chemical Name:
6,8-Dimethyl-2-(4-propylphenyl)quinoline-4-carbonyl chloride
CAS Number:
1160255-01-5
Molecular Formula:
C21H20ClNO
Molecular Weight:
337.8426
MDL Number:
MFCD03421242
IUPAC Name:
6,8-dimethyl-2-(4-propylphenyl)quinoline-4-carbonyl chloride
InChI:
InChI=1S/C21H20ClNO/c1-4-5-15-6-8-16(9-7-15)19-12-18(21(22)24)17-11-13(2)10-14(3)20(17)23-19/h6-12H,4-5H2,1-3H3
InChI Key:
XKBKFPDUDLKXFT-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)c1cc(C(=O)Cl)c2c(n1)c(C)cc(c2)C
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.123g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.847g/mol
Monoisotopic Mass:
337.123g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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