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117291-44-8 | 1H-Inden-1-one, 3-amino-2,3-dihydro-
CAS No: 117291-44-8 Catalog No: AG000E2I MDL No:MFCD09265346
Product Description
Catalog Number:
AG000E2I
Chemical Name:
1H-Inden-1-one, 3-amino-2,3-dihydro-
CAS Number:
117291-44-8
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD09265346
IUPAC Name:
3-amino-2,3-dihydroinden-1-one
InChI:
InChI=1S/C9H9NO/c10-8-5-9(11)7-4-2-1-3-6(7)8/h1-4,8H,5,10H2
InChI Key:
HNXHMCTUYDVMNC-UHFFFAOYSA-N
SMILES:
O=C1CC(c2c1cccc2)N
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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