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69707-18-2 | IMIDAZO[2,1-A]ISOQUINOLINE-2-CARBOXYLIC ACID ETHYL ESTER
CAS No: 69707-18-2 Catalog No: AG005IVJ MDL No:
Product Description
Catalog Number:
AG005IVJ
Chemical Name:
IMIDAZO[2,1-A]ISOQUINOLINE-2-CARBOXYLIC ACID ETHYL ESTER
CAS Number:
69707-18-2
Molecular Formula:
C14H12N2O2
Molecular Weight:
240.2573
IUPAC Name:
ethyl imidazo[2,1-a]isoquinoline-2-carboxylate
InChI:
InChI=1S/C14H12N2O2/c1-2-18-14(17)12-9-16-8-7-10-5-3-4-6-11(10)13(16)15-12/h3-9H,2H2,1H3
InChI Key:
SJPJZLTUCNZIHN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cn2c(n1)c1ccccc1cc2
NSC Number:
166104
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.262g/mol
Monoisotopic Mass:
240.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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