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891642-99-2 | 2-(3,4-DIHYDRO-2(1H)-ISOQUINOLINYL)-2-METHYL-1-PROPANAMINE
CAS No: 891642-99-2 Catalog No: AG003WGR MDL No:MFCD05201595
Product Description
Catalog Number:
AG003WGR
Chemical Name:
2-(3,4-DIHYDRO-2(1H)-ISOQUINOLINYL)-2-METHYL-1-PROPANAMINE
CAS Number:
891642-99-2
Molecular Formula:
C13H20N2
Molecular Weight:
204.3113
MDL Number:
MFCD05201595
IUPAC Name:
2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropan-1-amine
InChI:
InChI=1S/C13H20N2/c1-13(2,10-14)15-8-7-11-5-3-4-6-12(11)9-15/h3-6H,7-10,14H2,1-2H3
InChI Key:
RUZNMAAWLDJWOC-UHFFFAOYSA-N
SMILES:
NCC(N1CCc2c(C1)cccc2)(C)C
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.163g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.317g/mol
Monoisotopic Mass:
204.163g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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