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116817-11-9 | 2-Thiophenepropanamine, N,N-dimethyl-γ-(1-naphthalenyloxy)-
CAS No: 116817-11-9 Catalog No: AG000D9O MDL No:MFCD09750960
Product Description
Catalog Number:
AG000D9O
Chemical Name:
2-Thiophenepropanamine, N,N-dimethyl-γ-(1-naphthalenyloxy)-
CAS Number:
116817-11-9
Molecular Formula:
C19H21NOS
Molecular Weight:
311.4411
MDL Number:
MFCD09750960
IUPAC Name:
N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-ylpropan-1-amine;hydrochloride
InChI:
InChI=1S/C18H19NOS.ClH/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16;/h2-10,13,17,19H,11-12H2,1H3;1H
InChI Key:
BFFSMCNJSOPUAY-UHFFFAOYSA-N
SMILES:
CN(CCC(c1cccs1)Oc1cccc2c1cccc2)C
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.095g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
333.874g/mol
Monoisotopic Mass:
333.095g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
49.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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