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1199782-73-4 | 1H-Inden-1-one, 6-(aminomethyl)-2,3-dihydro-
CAS No: 1199782-73-4 Catalog No: AG000PXV MDL No:MFCD12828309
Product Description
Catalog Number:
AG000PXV
Chemical Name:
1H-Inden-1-one, 6-(aminomethyl)-2,3-dihydro-
CAS Number:
1199782-73-4
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD12828309
IUPAC Name:
6-(aminomethyl)-2,3-dihydroinden-1-one
InChI:
InChI=1S/C10H11NO/c11-6-7-1-2-8-3-4-10(12)9(8)5-7/h1-2,5H,3-4,6,11H2
InChI Key:
FMHPHYXBASCDPQ-UHFFFAOYSA-N
SMILES:
NCc1ccc2c(c1)C(=O)CC2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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