200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 67832-78-4
67832-78-4 | 4H-1-Benzopyran-4-one, 7-hydroxy-3-(1H-imidazol-4-yl)-
CAS No: 67832-78-4 Catalog No: AG005PMH MDL No:
Product Description
Catalog Number:
AG005PMH
Chemical Name:
4H-1-Benzopyran-4-one, 7-hydroxy-3-(1H-imidazol-4-yl)-
CAS Number:
67832-78-4
Molecular Formula:
C12H8N2O3
Molecular Weight:
228.2035
IUPAC Name:
7-hydroxy-3-(1H-imidazol-5-yl)chromen-4-one
InChI:
InChI=1S/C12H8N2O3/c15-7-1-2-8-11(3-7)17-5-9(12(8)16)10-4-13-6-14-10/h1-6,15H,(H,13,14)
InChI Key:
WDXIGGNZYIVLJL-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)occ(c2=O)c1c[nH]cn1
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.053g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.207g/mol
Monoisotopic Mass:
228.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.