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126921-47-9 | Isoquinoline, 1-[2-(4-morpholinyl)ethyl]-
CAS No: 126921-47-9 Catalog No: AG000TGL MDL No:
Product Description
Catalog Number:
AG000TGL
Chemical Name:
Isoquinoline, 1-[2-(4-morpholinyl)ethyl]-
CAS Number:
126921-47-9
Molecular Formula:
C15H18N2O
Molecular Weight:
242.3162
IUPAC Name:
4-(2-isoquinolin-1-ylethyl)morpholine
InChI:
InChI=1S/C15H18N2O/c1-2-4-14-13(3-1)5-7-16-15(14)6-8-17-9-11-18-12-10-17/h1-5,7H,6,8-12H2
InChI Key:
RFRSPLDAHWHJGQ-UHFFFAOYSA-N
SMILES:
O1CCN(CC1)CCc1nccc2c1cccc2
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.322g/mol
Monoisotopic Mass:
242.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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