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89224-67-9 | 4H-Furo[3,2-b]indole-2-carboxylic acid, 3-hydroxy-4-methyl-, ethyl ester
CAS No: 89224-67-9 Catalog No: AG0043WY MDL No:
Product Description
Catalog Number:
AG0043WY
Chemical Name:
4H-Furo[3,2-b]indole-2-carboxylic acid, 3-hydroxy-4-methyl-, ethyl ester
CAS Number:
89224-67-9
Molecular Formula:
C14H13NO4
Molecular Weight:
259.2573
IUPAC Name:
ethyl 3-hydroxy-4-methylfuro[3,2-b]indole-2-carboxylate
InChI:
InChI=1S/C14H13NO4/c1-3-18-14(17)13-11(16)10-12(19-13)8-6-4-5-7-9(8)15(10)2/h4-7,16H,3H2,1-2H3
InChI Key:
BUOMKXFHDBIKSX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1oc2c(c1O)n(c1c2cccc1)C
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.084g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.261g/mol
Monoisotopic Mass:
259.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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