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1239699-07-0

1239699-07-0 | 1H-Indole-2,3-dione, 5-fluoro-7-methoxy-

CAS No: 1239699-07-0 Catalog No: AG000LAE MDL No:

Product Description

Catalog Number:
AG000LAE
Chemical Name:
1H-Indole-2,3-dione, 5-fluoro-7-methoxy-
CAS Number:
1239699-07-0
Molecular Formula:
C9H6FNO3
Molecular Weight:
195.1472
IUPAC Name:
5-fluoro-7-methoxy-1H-indole-2,3-dione
InChI:
InChI=1S/C9H6FNO3/c1-14-6-3-4(10)2-5-7(6)11-9(13)8(5)12/h2-3H,1H3,(H,11,12,13)
InChI Key:
SRXPZFHNRROWFN-UHFFFAOYSA-N
SMILES:
COc1cc(F)cc2c1NC(=O)C2=O

Properties

Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.033g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.149g/mol
Monoisotopic Mass:
195.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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