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Home > Indoles and Oxindole > 22641-00-5
22641-00-5 | Pyrimido[2,1-a]isoindol-6(2H)-one, 3,4-dihydro-
CAS No: 22641-00-5 Catalog No: AG007O2J MDL No:MFCD00089469
Product Description
Catalog Number:
AG007O2J
Chemical Name:
Pyrimido[2,1-a]isoindol-6(2H)-one, 3,4-dihydro-
CAS Number:
22641-00-5
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD00089469
IUPAC Name:
3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-one
InChI:
InChI=1S/C11H10N2O/c14-11-9-5-2-1-4-8(9)10-12-6-3-7-13(10)11/h1-2,4-5H,3,6-7H2
InChI Key:
FBGOGHDRVWRWSS-UHFFFAOYSA-N
SMILES:
O=C1N2CCCN=C2c2c1cccc2
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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