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2487-72-1 | 1H-Isoindole-1,3(2H)-dione, 2-methyl-5-(methylamino)-
CAS No: 2487-72-1 Catalog No: AG002PPT MDL No:
Product Description
Catalog Number:
AG002PPT
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-methyl-5-(methylamino)-
CAS Number:
2487-72-1
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
IUPAC Name:
2-methyl-5-(methylamino)isoindole-1,3-dione
InChI:
InChI=1S/C10H10N2O2/c1-11-6-3-4-7-8(5-6)10(14)12(2)9(7)13/h3-5,11H,1-2H3
InChI Key:
YCOLGRLQJGCUFT-UHFFFAOYSA-N
SMILES:
CNc1ccc2c(c1)C(=O)N(C2=O)C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.202g/mol
Monoisotopic Mass:
190.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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