200,000+ products from a single source!
sales@angenechem.com
54558-06-4 | 3(2H)-Pyridazinone, 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS No: 54558-06-4 Catalog No: AG01AQHQ MDL No:MFCD16652678
Product Description
Catalog Number:
AG01AQHQ
Chemical Name:
3(2H)-Pyridazinone, 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS Number:
54558-06-4
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
MDL Number:
MFCD16652678
IUPAC Name:
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyridazin-6-one
InChI:
InChI=1S/C12H10N2O3/c15-12-4-2-9(13-14-12)8-1-3-10-11(7-8)17-6-5-16-10/h1-4,7H,5-6H2,(H,14,15)
InChI Key:
AFBVWGIDZFYWLV-UHFFFAOYSA-N
SMILES:
Oc1ccc(nn1)c1ccc2c(c1)OCCO2
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.