Home Carboxys methyl 1,4-dihydroquinoline-3-carboxylate

methyl 1,4-dihydroquinoline-3-carboxylate

CAS No.:
53936-94-0
Catalog Number:
AG01C22D
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
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Product Description
Catalog Number:
AG01C22D
Chemical Name:
methyl 1,4-dihydroquinoline-3-carboxylate
CAS Number:
53936-94-0
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD20663004
IUPAC Name:
methyl 1,4-dihydroquinoline-3-carboxylate
InChI:
InChI=1S/C11H11NO2/c1-14-11(13)9-6-8-4-2-3-5-10(8)12-7-9/h2-5,7,12H,6H2,1H3
InChI Key:
FQLQTNUWLFCKBJ-UHFFFAOYSA-N
SMILES:
COC(=O)C1=CNc2c(C1)cccc2
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties