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89224-83-9 | 4H-Furo[3,2-b]indole-2-carboxylic acid, 3-ethoxy-4-phenyl-
CAS No: 89224-83-9 Catalog No: AG0044LY MDL No:
Product Description
Catalog Number:
AG0044LY
Chemical Name:
4H-Furo[3,2-b]indole-2-carboxylic acid, 3-ethoxy-4-phenyl-
CAS Number:
89224-83-9
Molecular Formula:
C19H15NO4
Molecular Weight:
321.3267
IUPAC Name:
3-ethoxy-4-phenylfuro[3,2-b]indole-2-carboxylic acid
InChI:
InChI=1S/C19H15NO4/c1-2-23-17-15-16(24-18(17)19(21)22)13-10-6-7-11-14(13)20(15)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,21,22)
InChI Key:
YUEDRIPQRRVFJV-UHFFFAOYSA-N
SMILES:
CCOc1c(oc2c1n(c1ccccc1)c1c2cccc1)C(=O)O
Properties
Complexity:
464
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.1g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.332g/mol
Monoisotopic Mass:
321.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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