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16307-16-7 | 1H-Inden-1-one, 2-[[4-(dimethylamino)phenyl]methyl]-2,3-dihydro-
CAS No: 16307-16-7 Catalog No: AG001TOA MDL No:
Product Description
Catalog Number:
AG001TOA
Chemical Name:
1H-Inden-1-one, 2-[[4-(dimethylamino)phenyl]methyl]-2,3-dihydro-
CAS Number:
16307-16-7
Molecular Formula:
C18H19NO
Molecular Weight:
265.3496
IUPAC Name:
2-[[4-(dimethylamino)phenyl]methyl]-2,3-dihydroinden-1-one
InChI:
InChI=1S/C18H19NO/c1-19(2)16-9-7-13(8-10-16)11-15-12-14-5-3-4-6-17(14)18(15)20/h3-10,15H,11-12H2,1-2H3
InChI Key:
UVVJPRZIYGETFV-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)CC1Cc2c(C1=O)cccc2)C
NSC Number:
150178
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.147g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.356g/mol
Monoisotopic Mass:
265.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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