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101602-31-7 | Quinoline, 4-chloro-6,8-dimethyl-2-phenyl-
CAS No: 101602-31-7 Catalog No: AG0004YQ MDL No:
Product Description
Catalog Number:
AG0004YQ
Chemical Name:
Quinoline, 4-chloro-6,8-dimethyl-2-phenyl-
CAS Number:
101602-31-7
Molecular Formula:
C17H14ClN
Molecular Weight:
267.7528
IUPAC Name:
4-chloro-6,8-dimethyl-2-phenylquinoline
InChI:
InChI=1S/C17H14ClN/c1-11-8-12(2)17-14(9-11)15(18)10-16(19-17)13-6-4-3-5-7-13/h3-10H,1-2H3
InChI Key:
MCCJMSALUBTGDI-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c2c(c1)c(Cl)cc(n2)c1ccccc1
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.081g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.756g/mol
Monoisotopic Mass:
267.081g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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