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114318-44-4

114318-44-4 | Furo[2,3-b]quinoline, 4,7,8-trimethoxy-, ethanedioate (1:1)

CAS No: 114318-44-4 Catalog No: AG000B2T MDL No:

Product Description

Catalog Number:
AG000B2T
Chemical Name:
Furo[2,3-b]quinoline, 4,7,8-trimethoxy-, ethanedioate (1:1)
CAS Number:
114318-44-4
Molecular Formula:
C16H15NO8
Molecular Weight:
349.2922
IUPAC Name:
oxalic acid;4,7,8-trimethoxyfuro[2,3-b]quinoline
InChI:
InChI=1S/C14H13NO4.C2H2O4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2;3-1(4)2(5)6/h4-7H,1-3H3;(H,3,4)(H,5,6)
InChI Key:
HSZFRYWMNXAJAU-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)O.COc1ccc2c(c1OC)nc1c(c2OC)cco1

Properties

Complexity:
385  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.08g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
349.295g/mol
Monoisotopic Mass:
349.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
128A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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