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1133115-64-6 | Methyl 4,7-dichloro-8-methylquinoline-2-carboxylate
CAS No: 1133115-64-6 Catalog No: AG003RUA MDL No:MFCD11855878
Product Description
Catalog Number:
AG003RUA
Chemical Name:
Methyl 4,7-dichloro-8-methylquinoline-2-carboxylate
CAS Number:
1133115-64-6
Molecular Formula:
C12H9Cl2NO2
Molecular Weight:
270.1114
MDL Number:
MFCD11855878
IUPAC Name:
methyl 4,7-dichloro-8-methylquinoline-2-carboxylate
InChI:
InChI=1S/C12H9Cl2NO2/c1-6-8(13)4-3-7-9(14)5-10(12(16)17-2)15-11(6)7/h3-5H,1-2H3
InChI Key:
YCODGLFIKPZDTK-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Cl)c2c(n1)c(C)c(cc2)Cl
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.001g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.109g/mol
Monoisotopic Mass:
269.001g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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