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1190380-38-1 | 1H-Isoindol-1-one, 5-amino-2,3-dihydro-2-methyl-
CAS No: 1190380-38-1 Catalog No: AG000I40 MDL No:MFCD17214360
Product Description
Catalog Number:
AG000I40
Chemical Name:
1H-Isoindol-1-one, 5-amino-2,3-dihydro-2-methyl-
CAS Number:
1190380-38-1
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD17214360
IUPAC Name:
5-amino-2-methyl-3H-isoindol-1-one
InChI:
InChI=1S/C9H10N2O/c1-11-5-6-4-7(10)2-3-8(6)9(11)12/h2-4H,5,10H2,1H3
InChI Key:
VNYNRNAJJGDULT-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)CN(C2=O)C
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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