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83598-55-4 | 5,6-Dimethoxy-2,3-dihydro-1H-inden-2-amine
CAS No: 83598-55-4 Catalog No: AG004TT7 MDL No:MFCD08234972
Product Description
Catalog Number:
AG004TT7
Chemical Name:
5,6-Dimethoxy-2,3-dihydro-1H-inden-2-amine
CAS Number:
83598-55-4
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
MDL Number:
MFCD08234972
IUPAC Name:
5,6-dimethoxy-2,3-dihydro-1H-inden-2-amine
InChI:
InChI=1S/C11H15NO2/c1-13-10-5-7-3-9(12)4-8(7)6-11(10)14-2/h5-6,9H,3-4,12H2,1-2H3
InChI Key:
TZASGTHDRXFGHT-UHFFFAOYSA-N
SMILES:
COc1cc2CC(Cc2cc1OC)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:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Dopamine D(3) receptor antagonists. 1. Synthesis and structure-activity relationships of 5,6-dimethoxy-N-alkyl- and N-alkylaryl-substituted 2-aminoindans. | Journal of medicinal chemistry 20011220 |
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