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116680-81-0 | 2-Naphthalenamine, 1,2,3,4-tetrahydro-6,7-dimethoxy-N-propyl-
CAS No: 116680-81-0 Catalog No: AG000CZ2 MDL No:
Product Description
Catalog Number:
AG000CZ2
Chemical Name:
2-Naphthalenamine, 1,2,3,4-tetrahydro-6,7-dimethoxy-N-propyl-
CAS Number:
116680-81-0
Molecular Formula:
C15H23NO2
Molecular Weight:
249.3486
IUPAC Name:
6,7-dimethoxy-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
InChI:
InChI=1S/C15H23NO2/c1-4-7-16-13-6-5-11-9-14(17-2)15(18-3)10-12(11)8-13/h9-10,13,16H,4-8H2,1-3H3
InChI Key:
FAIPBMAIDHLQHJ-UHFFFAOYSA-N
SMILES:
CCCNC1CCc2c(C1)cc(c(c2)OC)OC
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.173g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.354g/mol
Monoisotopic Mass:
249.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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