Home Carboxys 1-Oxo-1H-isochromene-3-carboxylicAcid

1-Oxo-1H-isochromene-3-carboxylicAcid

CAS No.:
2289-03-4
Catalog Number:
AG01BCUU
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BCUU
Chemical Name:
1-Oxo-1H-isochromene-3-carboxylicAcid
CAS Number:
2289-03-4
MDL Number:
MFCD03819933
IUPAC Name:
1-oxoisochromene-3-carboxylic acid
InChI:
InChI=1S/C10H6O4/c11-9(12)8-5-6-3-1-2-4-7(6)10(13)14-8/h1-5H,(H,11,12)
InChI Key:
CRPAMTZHVXHTKH-UHFFFAOYSA-N
NSC Number:
403262
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.027g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.154g/mol
Monoisotopic Mass:
190.027g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
1,2-HOIQO--a highly versatile 1,2-HOPO analogue. Inorganic chemistry 20070122
Properties